Water
- Formula: H2O
- Molecular weight: 18.0153
- IUPAC Standard InChIKey: XLYOFNOQVPJJNP-UHFFFAOYSA-N
- CAS Registry Number: 7732-18-5
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Isotopologues:
- Other names: Water vapor; Distilled water; Ice; H2O; Dihydrogen oxide; steam; Tritiotope
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Condensed phase thermochemistry data
- Reaction thermochemistry data: reactions 1 to 50, reactions 51 to 100, reactions 101 to 150, reactions 151 to 200, reactions 201 to 250, reactions 251 to 300, reactions 301 to 350, reactions 351 to 400, reactions 401 to 450, reactions 451 to 500, reactions 501 to 550, reactions 551 to 600, reactions 601 to 650, reactions 651 to 700, reactions 701 to 750, reactions 751 to 800, reactions 801 to 850, reactions 851 to 900, reactions 901 to 950, reactions 951 to 1000, reactions 1001 to 1050, reactions 1051 to 1100, reactions 1101 to 1150, reactions 1151 to 1200, reactions 1201 to 1250, reactions 1251 to 1300, reactions 1301 to 1350, reactions 1351 to 1360
- Mass spectrum (electron ionization)
- Fluid Properties
- Data at other public NIST sites:
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- NIST / TRC Web Thermo Tables, "lite" edition (thermophysical and thermochemical data)
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Gas phase thermochemistry data
Go To: Top, Phase change data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Vibrational and/or electronic energy levels, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | -241.826 ± 0.040 | kJ/mol | Review | Cox, Wagman, et al., 1984 | CODATA Review value |
ΔfH°gas | -241.83 | kJ/mol | Review | Chase, 1998 | Data last reviewed in March, 1979 |
Quantity | Value | Units | Method | Reference | Comment |
S°gas,1 bar | 188.835 ± 0.010 | J/mol*K | Review | Cox, Wagman, et al., 1984 | CODATA Review value |
S°gas,1 bar | 188.84 | J/mol*K | Review | Chase, 1998 | Data last reviewed in March, 1979 |
Gas Phase Heat Capacity (Shomate Equation)
Cp° = A + B*t + C*t2 + D*t3 +
E/t2
H° − H°298.15= A*t + B*t2/2 +
C*t3/3 + D*t4/4 − E/t + F − H
S° = A*ln(t) + B*t + C*t2/2 + D*t3/3 −
E/(2*t2) + G
Cp = heat capacity (J/mol*K)
H° = standard enthalpy (kJ/mol)
S° = standard entropy (J/mol*K)
t = temperature (K) / 1000.
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Temperature (K) | 500. to 1700. | 1700. to 6000. |
---|---|---|
A | 30.09200 | 41.96426 |
B | 6.832514 | 8.622053 |
C | 6.793435 | -1.499780 |
D | -2.534480 | 0.098119 |
E | 0.082139 | -11.15764 |
F | -250.8810 | -272.1797 |
G | 223.3967 | 219.7809 |
H | -241.8264 | -241.8264 |
Reference | Chase, 1998 | Chase, 1998 |
Comment | Data last reviewed in March, 1979 | Data last reviewed in March, 1979 |
Phase change data
Go To: Top, Gas phase thermochemistry data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Vibrational and/or electronic energy levels, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 373.17 ± 0.04 | K | AVG | N/A | Average of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Ptriple | 0.0061 | bar | N/A | Sato, Watanabe, et al., 1991 | Uncertainty assigned by TRC = 1.×10-7 bar; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 647. ± 2. | K | AVG | N/A | Average of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 220.64 | bar | N/A | Sato, Watanabe, et al., 1991 | Uncertainty assigned by TRC = 0.05 bar; TRC |
Pc | 220.60 | bar | N/A | Brunner, 1990 | Uncertainty assigned by TRC = 0.12 bar; TRC |
Pc | 220.46 | bar | N/A | Morita, Sato, et al., 1989 | Uncertainty assigned by TRC = 0.25 bar; based on analysis of their obs. PVT and vapor pressure data some other data from literature; TRC |
Pc | 220.64 | bar | N/A | Aleksandrov, 1986 | Uncertainty assigned by TRC = 0.30 bar; TRC |
Pc | 220.64 | bar | N/A | Sifner, 1985 | Uncertainty assigned by TRC = 0.0001 bar; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ρc | 17.9 | mol/l | N/A | Sato, Watanabe, et al., 1991 | Uncertainty assigned by TRC = 0.2 mol/l; TRC |
ρc | 17.91 | mol/l | N/A | Morita, Sato, et al., 1989 | Uncertainty assigned by TRC = 0.083 mol/l; based on analysis of obs. PVT and vapor pressure data; TRC |
ρc | 17.9 | mol/l | N/A | Aleksandrov, 1986 | Uncertainty assigned by TRC = 0.2 mol/l; TRC |
ρc | 17.9 | mol/l | N/A | Sifner, 1985 | Uncertainty assigned by TRC = 0.2 mol/l; TRC |
Antoine Equation Parameters
log10(P) = A − (B / (T + C))
P = vapor pressure (bar)
T = temperature (K)
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Temperature (K) | A | B | C | Reference | Comment |
---|---|---|---|---|---|
379. to 573. | 3.55959 | 643.748 | -198.043 | Liu and Lindsay, 1970 | Coefficents calculated by NIST from author's data. |
273. to 303. | 5.40221 | 1838.675 | -31.737 | Bridgeman and Aldrich, 1964 | Coefficents calculated by NIST from author's data. |
304. to 333. | 5.20389 | 1733.926 | -39.485 | Bridgeman and Aldrich, 1964 | Coefficents calculated by NIST from author's data. |
334. to 363. | 5.0768 | 1659.793 | -45.854 | Bridgeman and Aldrich, 1964 | Coefficents calculated by NIST from author's data. |
344. to 373. | 5.08354 | 1663.125 | -45.622 | Bridgeman and Aldrich, 1964 | Coefficents calculated by NIST from author's data. |
293. to 343. | 6.20963 | 2354.731 | 7.559 | Gubkov, Fermor, et al., 1964 | Coefficents calculated by NIST from author's data. |
255.9 to 373. | 4.6543 | 1435.264 | -64.848 | Stull, 1947 | Coefficents calculated by NIST from author's data. |
Gas phase ion energetics data
Go To: Top, Gas phase thermochemistry data, Phase change data, Ion clustering data, IR Spectrum, Vibrational and/or electronic energy levels, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
L - Sharon G. Lias
Data compiled as indicated in comments:
B - John E. Bartmess
LL - Sharon G. Lias and Joel F. Liebman
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
View reactions leading to H2O+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
IE (evaluated) | 12.621 ± 0.002 | eV | N/A | N/A | L |
Quantity | Value | Units | Method | Reference | Comment |
Proton affinity (review) | 691. | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 660.0 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Ionization energy determinations
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
H+ | 16.95 ± 0.05 | OH | EI | Lefaivre and Marmet, 1978 | LLK |
H+ | 18.7 ± 0.05 | OH(X2P) | EI | Appell and Durup, 1973 | LLK |
H+ | 16.0 ± 0.3 | OH- | EI | Cottin, 1959 | RDSH |
H+ | 19.6 ± 0.25 | OH | EI | Cottin, 1959 | RDSH |
HO+ | 18.08 ± 0.05 | H | EI | Lefaivre and Marmet, 1978 | LLK |
HO+ | 18.115 ± 0.008 | H | PI | McCulloh, 1976 | LLK |
HO+ | 18.2 | H | EI | Morrison and Traeger, 1973 | LLK |
HO+ | 18.05 | H | PI | Dibeler, Walker, et al., 1966 | RDSH |
HO+ | 18.2 ± 0.1 | H | EI | Foner and Hudson, 1956 | RDSH |
H2+ | 20.7 ± 0.4 | O | EI | Ehrhardt and Kresling, 1967 | RDSH |
O+ | 19.0 | H2 | EI | Morrison and Traeger, 1973 | LLK |
O+ | 26.8 | 2H | EI | Morrison and Traeger, 1973 | LLK |
O+ | 19.0 ± 0.2 | H2 | EI | Ehrhardt and Kresling, 1967 | RDSH |
O+ | 26.5 ± 0.3 | 2H? | EI | Ehrhardt and Kresling, 1967 | RDSH |
O+ | 29.15 ± 0.25 | 2H? | EI | Cottin, 1959 | RDSH |
De-protonation reactions
HO- + =
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1633.141 ± 0.042 | kJ/mol | D-EA | Smith, Kim, et al., 1997 | gas phase; Given: 14741.02(3) cm-1. dHacid(0K) = 389.11±0.014; B |
ΔrH° | 1622.1 | kJ/mol | N/A | Check, Faust, et al., 2001 | gas phase; MnBr3-; ; ΔS(EA)=1.7; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 1605.57 ± 0.25 | kJ/mol | H-TS | Smith, Kim, et al., 1997 | gas phase; Given: 14741.02(3) cm-1. dHacid(0K) = 389.11±0.014; B |
ΔrG° | 1594.5 | kJ/mol | N/A | Check, Faust, et al., 2001 | gas phase; MnBr3-; ; ΔS(EA)=1.7; B |
Ion clustering data
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, IR Spectrum, Vibrational and/or electronic energy levels, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
B - John E. Bartmess
RCD - Robert C. Dunbar
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. Searches may be limited to ion clustering reactions. A general reaction search form is also available.
Clustering reactions
By formula: Ag+ + H2O = (Ag+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 139. | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 119. | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
By formula: (Ag+ • H2O) + H2O = (Ag+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 106. | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 93.3 | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
By formula: (Ag+ • 2H2O) + H2O = (Ag+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 62.8 | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.4 | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
By formula: (Ag+ • 3H2O) + H2O = (Ag+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 62.3 | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 123. | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
By formula: (Ag+ • 4H2O) + H2O = (Ag+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.3 | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 127. | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
By formula: (Ag+ • 5H2O) + H2O = (Ag+ • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.6 | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 135. | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
By formula: Al+ + H2O = (Al+ • H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
104. (+15.,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Al+ (3s2); M |
By formula: (Al+ • H2O) + H2O = (Al+ • 2H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
67.4 (+5.0,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Al+ (3s2); M |
By formula: (Al+ • 2H2O) + H2O = (Al+ • 3H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
63.6 (+7.5,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Al+ (3s2); M |
By formula: (Al+ • 3H2O) + H2O = (Al+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
52.3 (+5.9,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Al+ (3s2); M |
By formula: Bi+ + H2O = (Bi+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 95.4 | kJ/mol | HPMS | Tang and Castleman, 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | HPMS | Tang and Castleman, 1974 | gas phase; M |
By formula: (Bi+ • H2O) + H2O = (Bi+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.1 | kJ/mol | HPMS | Tang and Castleman, 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 107. | J/mol*K | HPMS | Tang and Castleman, 1974 | gas phase; M |
By formula: (Bi+ • 2H2O) + H2O = (Bi+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.6 | kJ/mol | HPMS | Tang and Castleman, 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | HPMS | Tang and Castleman, 1974 | gas phase; M |
By formula: (Bi+ • 3H2O) + H2O = (Bi+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.2 | kJ/mol | HPMS | Tang and Castleman, 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.3 | J/mol*K | HPMS | Tang and Castleman, 1974 | gas phase; M |
By formula: (Bi+ • 4H2O) + H2O = (Bi+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.9 | kJ/mol | HPMS | Tang and Castleman, 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.0 | J/mol*K | HPMS | Tang and Castleman, 1974 | gas phase; M |
By formula: (Bi+ • 5H2O) + H2O = (Bi+ • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | HPMS | Tang and Castleman, 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.7 | J/mol*K | HPMS | Tang and Castleman, 1974 | gas phase; M |
By formula: Br- + H2O = (Br- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.14 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 49.0 ± 1.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 52.72 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
ΔrH° | 53.1 | kJ/mol | HPMS | Caldwell, Masucci, et al., 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 61.5 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 77.0 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
ΔrS° | 82.8 | J/mol*K | MS | Burdett and Hayhurst, 1982 | gas phase; FLAME SOURCE, 1600 K; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 30.5 ± 3.3 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 29. ± 12. | kJ/mol | TDAs | Burdett and Hayhurst, 1982 | gas phase; B |
ΔrG° | 29. ± 8.4 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
By formula: (Br- • H2O) + H2O = (Br- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 ± 1.3 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 51.04 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 51.5 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrH° | 51.5 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 75.3 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 95.8 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 4.2 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 23. ± 5.9 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrG° | 22.6 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 24. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (Br- • 2H2O) + H2O = (Br- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 ± 1.3 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 28.9 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 48.1 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrH° | 48.1 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.1 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 104. | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20. ± 4.6 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 17. ± 5.9 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrG° | 17.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 18. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (Br- • 3H2O) + H2O = (Br- • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.02 ± 0.84 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 26. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 45.6 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 112. | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 13.0 ± 2.9 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 12.1 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 14. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (Br- • 4H2O) + H2O = (Br- • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.2 ± 1.3 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 26. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 119. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 9.6 ± 5.0 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
By formula: (Br- • 5H2O) + H2O = (Br- • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 ± 2.1 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 25. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 118. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 7.5 ± 8.8 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
By formula: (Br- • 6H2O) + H2O = (Br- • 7H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.84 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy estimated; B,M |
ΔrH° | 10. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | N/A | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 5.44 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy estimated; B |
By formula: (Br- • 7H2O) + H2O = (Br- • 8H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.7 ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 8H2O) + H2O = (Br- • 9H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 9H2O) + H2O = (Br- • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.7 ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 10H2O) + H2O = (Br- • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.7 ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 11H2O) + H2O = (Br- • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 12H2O) + H2O = (Br- • 13H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.5 ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 13H2O) + H2O = (Br- • 14H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 13. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 14H2O) + H2O = (Br- • 15H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -2. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (Br- • 15H2O) + H2O = (Br- • 16H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.6 ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: CF3+ + H2O = (CF3+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 19. | kJ/mol | HPMS | Bennet and Field, 1972 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.7 | J/mol*K | HPMS | Bennet and Field, 1972 | gas phase; M |
By formula: CF3O- + H2O = CH2F3O2-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28. ± 4.2 | kJ/mol | N/A | Amelynck, Van Bavel, et al., 2000 | gas phase; B |
By formula: CF3O3S- + H2O = (CF3O3S- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
(CF3O3S- • ) +
= (CF3O3S- • 2
)
By formula: (CF3O3S- • H2O) + H2O = (CF3O3S- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 15.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: CHO2- + H2O = (CHO2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 66.9 ± 4.2 | kJ/mol | TDAs | Meot-Ner and Sieck, 1986 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.2 | J/mol*K | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 38. ± 6.7 | kJ/mol | TDAs | Meot-Ner and Sieck, 1986 | gas phase; B |
ΔrG° | 35.1 ± 0.84 | kJ/mol | N/A | Viidanoja, Reiner, et al., 2000 | gas phase; B |
ΔrG° | 38.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (CHO2- • H2O) + H2O = (CHO2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 28.9 ± 0.84 | kJ/mol | N/A | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: (CHO2- • 2H2O) + H2O = (CHO2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.6 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 21.8 ± 0.84 | kJ/mol | N/A | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: CHO3- + H2O = CH3O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.69 ± 0.84 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 35.6 ± 1.7 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
By formula: (CH2N+ • CHN) + H2O = (CH2N+ • H2O • CHN)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 84.1 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
By formula: CH2N+ + H2O = (CH2N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 115. | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
ΔrH° | 124. | kJ/mol | ICR | Berman and Beauchamp, 1980 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
ΔrS° | 120. | J/mol*K | N/A | Berman and Beauchamp, 1980 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
87.9 | 300. | ICR | Berman and Beauchamp, 1980 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
(CH2N+ • •
) +
= (CH2N+ • 2
•
)
By formula: (CH2N+ • H2O • CHN) + H2O = (CH2N+ • 2H2O • CHN)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.7 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.6 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
By formula: (CH2N+ • H2O) + H2O = (CH2N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 89.5 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 106. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
By formula: (CH2N+ • 2H2O) + H2O = (CH2N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.0 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
By formula: CH2NO5- + H2O + CH2O2 = CH4NO6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18.4 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: CH2O2S- + 2H2O = CH4O3S-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.8 ± 8.4 | kJ/mol | N/A | Surber and Sanov, 2002 | gas phase; Stated electron affinity is the Vertical Detachment Energy; B |
By formula: CH2O4- + 2H2O = CH4O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 ± 2.1 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20. ± 4.2 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
By formula: CH3O+ + H2O = (CH3O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 119. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; switching reaction(H3O+)H2O; Davidson, Sunner J., et al., 1979, Lias, Liebman, et al., 1984; M |
ΔrH° | 117. | kJ/mol | ICR | Larson and McMahon, 1982 | gas phase; switching reaction((CH3)2O)2H+)(CH3)2O, Entropy change calculated or estimated; Grimsrud and Kebarle, 1973, Yamdagni and Kebarle, 1976, Wolf, Staley, et al., 1977; M |
ΔrH° | 119. | kJ/mol | ICR | Berman and Beauchamp, 1980 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrH° | 120. | kJ/mol | FA | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrH° | 120. | kJ/mol | FA | Fehsenfeld, Dotan, et al., 1978 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O; Lias, Liebman, et al., 1984, Meot-Ner (Mautner), 1992; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | N/A | Berman and Beauchamp, 1980 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrS° | 113. | J/mol*K | N/A | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrS° | 112. | J/mol*K | FA | Fehsenfeld, Dotan, et al., 1978 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O; Lias, Liebman, et al., 1984, Meot-Ner (Mautner), 1992; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 85.4 | kJ/mol | ICR | Berman and Beauchamp, 1980 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrG° | 85.8 | kJ/mol | FA | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
By formula: (CH3O+ • H2O) + H2O = (CH3O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 90.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 83.3 | kJ/mol | FA | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)2H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrH° | 82.8 | kJ/mol | FA | Fehsenfeld, Dotan, et al., 1978 | gas phase; From thermochemical cycle,switching reaction(H3O+)2H2O; Lias, Liebman, et al., 1984, Meot-Ner (Mautner), 1992; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 110. | J/mol*K | N/A | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)2H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrS° | 110. | J/mol*K | FA | Fehsenfeld, Dotan, et al., 1978 | gas phase; From thermochemical cycle,switching reaction(H3O+)2H2O; Lias, Liebman, et al., 1984, Meot-Ner (Mautner), 1992; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 50.6 | kJ/mol | FA | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)2H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
By formula: (CH3O+ • 2H2O) + H2O = (CH3O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73.6 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 70.7 | kJ/mol | FA | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)3H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrH° | 71.1 | kJ/mol | FA | Fehsenfeld, Dotan, et al., 1978 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O; Lias, Liebman, et al., 1984, Meot-Ner (Mautner), 1992; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 107. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 109. | J/mol*K | N/A | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)3H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
ΔrS° | 109. | J/mol*K | FA | Fehsenfeld, Dotan, et al., 1978 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O; Lias, Liebman, et al., 1984, Meot-Ner (Mautner), 1992; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 38. | kJ/mol | FA | Bohme, Mackay, et al., 1979 | gas phase; From thermochemical cycle,switching reaction(H3O+)3H2O, Entropy change calculated or estimated; Lias, Liebman, et al., 1984, Fehsenfeld, Dotan, et al., 1978, Meot-Ner (Mautner), 1992; M |
By formula: (CH3O+ • 3H2O) + H2O = (CH3O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.1 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH3O+ • 4H2O) + H2O = (CH3O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.4 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.6 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH3O+ • 5H2O) + H2O = (CH3O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH3O+ • 6H2O) + H2O = (CH3O+ • 7H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH3O- • CH4O) + H2O = (CH3O- • H2O • CH4O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.5 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
By formula: (CH3O- • 2CH4O) + H2O = (CH3O- • H2O • 2CH4O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
By formula: CH3O- + H2O = (CH3O- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 106. ± 9.2 | kJ/mol | CIDT | DeTuri and Ervin, 1999 | gas phase; B |
ΔrH° | 100. | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M,B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.8 | J/mol*K | PHPMS | Meot-ner and Sieck, 1986 | gas phase; M |
ΔrS° | 95.8 | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 71.1 ± 1.3 | kJ/mol | TDAs | Meot-ner and Sieck, 1986 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
64.4 | 296. | FA | MacKay and Bohme, 1978 | gas phase; From thermochemical cycle,switching reaction(OH-)H2O, DG>; Meot-Ner(Mautner), 1986; M |
(CH3O- • •
) +
= (CH3O- • 2
•
)
By formula: (CH3O- • H2O • CH4O) + H2O = (CH3O- • 2H2O • CH4O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.6 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 116. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
By formula: (CH3O- • H2O) + H2O = (CH3O- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 80.3 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 106. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 296. | FA | MacKay and Bohme, 1978 | gas phase; From thermochemical cycle,switching reaction(OH-)2H2O; Meot-Ner(Mautner), 1986; M |
By formula: (CH3O- • 2H2O) + H2O = (CH3O- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.9 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 296. | FA | MacKay and Bohme, 1978 | gas phase; From thermochemical cycle,switching reaction(OH-)3H2O; Meot-Ner(Mautner), 1986; M |
By formula: (CH3O- • 3H2O) + H2O = (CH3O- • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 83.7 | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
By formula: CH3O3S- + H2O = (CH3O3S- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
(CH3O3S- • ) +
= (CH3O3S- • 2
)
By formula: (CH3O3S- • H2O) + H2O = (CH3O3S- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.9 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
(CH3O3S- • 2) +
= (CH3O3S- • 3
)
By formula: (CH3O3S- • 2H2O) + H2O = (CH3O3S- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: CH3O4- + 2H2O = CH5O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 62.34 ± 0.84 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 4.2 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
By formula: CH3S- + H2O = (CH3S- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 62.76 ± 0.84 | kJ/mol | TDAs | Sieck and Meot-ner, 1989 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.7 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 36.4 ± 2.9 | kJ/mol | TDAs | Sieck and Meot-ner, 1989 | gas phase; B |
By formula: (CH3S- • H2O) + H2O = (CH3S- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.5 | kJ/mol | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.3 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
By formula: (CH3S- • 2H2O) + H2O = (CH3S- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.4 | kJ/mol | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 85.8 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
By formula: (CH3S- • 3H2O) + H2O = (CH3S- • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 80.3 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
By formula: CH4NO+ + H2O = (CH4NO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 88.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 89.1 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 114. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 114. | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
By formula: (CH4NO+ • H2O) + H2O = (CH4NO+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.6 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 58.6 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.4 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 95.0 | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
By formula: (CH4NO+ • 2H2O) + H2O = (CH4NO+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 49.4 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.9 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 87.9 | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
By formula: (CH4NO+ • 3H2O) + H2O = (CH4NO+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 84.5 | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
By formula: (CH4NO+ • 4H2O) + H2O = (CH4NO+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 107. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 107. | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
By formula: CH4O5- + 3H2O = CH6O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 ± 3.3 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 14. ± 4.2 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
By formula: (CH5O+ • CH4O) + H2O = (CH5O+ • H2O • CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 77.0 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
By formula: (CH5O+ • 3CH4O) + H2O = (CH5O+ • H2O • 3CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.6 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
By formula: (CH5O+ • 4CH4O) + H2O = (CH5O+ • H2O • 4CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.6 | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
By formula: CH5O+ + H2O = (CH5O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 115. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 100. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 123. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 96. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(CH5O+ • • 2
) +
= (CH5O+ • 2
• 2
)
By formula: (CH5O+ • H2O • 2CH4O) + H2O = (CH5O+ • 2H2O • 2CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 107. | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
(CH5O+ • • 3
) +
= (CH5O+ • 2
• 3
)
By formula: (CH5O+ • H2O • 3CH4O) + H2O = (CH5O+ • 2H2O • 3CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 36. | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 79.5 | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
(CH5O+ • 2 •
) +
= (CH5O+ • 3
•
)
By formula: (CH5O+ • 2H2O • CH4O) + H2O = (CH5O+ • 3H2O • CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.2 | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
(CH5O+ • 2 • 2
) +
= (CH5O+ • 3
• 2
)
By formula: (CH5O+ • 2H2O • 2CH4O) + H2O = (CH5O+ • 3H2O • 2CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
(CH5O+ • 2 • 3
) +
= (CH5O+ • 3
• 3
)
By formula: (CH5O+ • 2H2O • 3CH4O) + H2O = (CH5O+ • 3H2O • 3CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 272. | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
(CH5O+ • 3 •
) +
= (CH5O+ • 4
•
)
By formula: (CH5O+ • 3H2O • CH4O) + H2O = (CH5O+ • 4H2O • CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.3 | J/mol*K | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n; M |
(CH5O+ • 3 • 2
) +
= (CH5O+ • 4
• 2
)
By formula: (CH5O+ • 3H2O • 2CH4O) + H2O = (CH5O+ • 4H2O • 2CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 272. | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
(CH5O+ • 4 •
) +
= (CH5O+ • 5
•
)
By formula: (CH5O+ • 4H2O • CH4O) + H2O = (CH5O+ • 5H2O • CH4O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 269. | PHPMS | Meot-Ner(Mautner), 1986 | gas phase; n, Entropy change calculated or estimated; M |
By formula: (CH5O+ • H2O) + H2O = (CH5O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 82.8 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 87.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 114. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 121. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH5O+ • 2H2O) + H2O = (CH5O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.0 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 61.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH5O+ • 3H2O) + H2O = (CH5O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 48.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.2 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 92.5 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH5O+ • 4H2O) + H2O = (CH5O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 86.6 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 77.4 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH5O+ • 5H2O) + H2O = (CH5O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 92.9 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH5O+ • 6H2O) + H2O = (CH5O+ • 7H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 269. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: CH5O2- + 2H2O = CH7O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 80.3 ± 4.2 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 49.0 ± 2.1 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
By formula: CH5O5- + 3H2O = CH7O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 ± 1.3 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19. ± 4.2 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
By formula: CH5S+ + H2O = (CH5S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.9 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; Entropy change calculated or estimated; M |
ΔrH° | 56.5 | kJ/mol | ICR | Berman and Beauchamp, 1986 | gas phase; bracketing; Lias, Liebman, et al., 1984; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 476. | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; Entropy change calculated or estimated; M |
By formula: CH6N+ + H2O = (CH6N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 78.7 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
ΔrH° | 78.7 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.2 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 44.8 | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (CH6N+ • H2O) + H2O = (CH6N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 61.1 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
ΔrH° | 61.1 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 112. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
ΔrS° | 112. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 31. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (CH6N+ • 2H2O) + H2O = (CH6N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 51.9 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
ΔrH° | 51.9 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (CH6N+ • 3H2O) + H2O = (CH6N+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92.0 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (CH6N+ • 4H2O) + H2O = (CH6N+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 85.4 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 269. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: (CH6N+ • 5H2O) + H2O = (CH6N+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 36. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.4 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 259. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: CH7O3- + 3H2O = CH9O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.9 ± 4.2 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 31.4 ± 2.1 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
By formula: CH7O6- + 4H2O = CH9O7-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.1 ± 3.8 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 14. ± 4.2 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
By formula: CH9O4- + 4H2O = CH11O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 ± 4.2 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21.3 ± 2.1 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
By formula: (CN- • CHN) + H2O = (CN- • H2O • CHN)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.9 ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.4 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 27. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B |
By formula: (CN- • 2CHN) + H2O = (CN- • H2O • 2CHN)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 32. ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 52.3 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 17. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B |
By formula: (CN- • 3CHN) + H2O = (CN- • H2O • 3CHN)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 14. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 262. | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
By formula: CN- + H2O = (CN- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.1 ± 3.3 | kJ/mol | TDAs | Larson, Szulejko, et al., 1988 | gas phase; B,M |
ΔrH° | 61.1 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B,B,M,M |
ΔrH° | 57.74 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B,M |
ΔrH° | 61.1 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.0 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
ΔrS° | 75. | J/mol*K | PHPMS | Larson, Szulejko, et al., 1988 | gas phase; M |
ΔrS° | 82.0 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
ΔrS° | 82.0 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
ΔrS° | 82.8 | J/mol*K | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 30.5 ± 0.84 | kJ/mol | TDAs | Larson, Szulejko, et al., 1988 | gas phase; B |
ΔrG° | 36. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988, 2 | gas phase; B |
ΔrG° | 36. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
ΔrG° | 33.1 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
By formula: (CN- • H2O • CHN) + H2O = (CN- • 2H2O • CHN)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 73.2 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B |
By formula: (CN- • H2O • 2CHN) + H2O = (CN- • 2H2O • 2CHN)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 12. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 262. | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
By formula: (CN- • 2H2O • CHN) + H2O = (CN- • 3H2O • CHN)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 36. ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 10. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B |
By formula: (CN- • H2O) + H2O = (CN- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B,M |
ΔrH° | 49.0 | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 75.7 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
ΔrS° | 75.7 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; B |
By formula: (CN- • 2H2O) + H2O = (CN- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.8 ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Stated EA is Vertical Detachment Energy, at 12 K. At 298 K, measured Vertical Detachment Energy = 5.50±0.10 eV; B,M |
ΔrH° | 44.8 | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.8 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n; M |
ΔrS° | 82.8 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 33. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Stated EA is Vertical Detachment Energy, at 12 K. At 298 K, measured Vertical Detachment Energy = 5.50±0.10 eV; B |
By formula: (CN- • 3H2O) + H2O = (CN- • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84. | J/mol*K | N/A | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 16. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) M. and Speller, 1989 | gas phase; Entropy estimated; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 262. | PHPMS | Meot-Ner (Mautner) and Speller, 1989 | gas phase; n, Entropy change calculated or estimated; M |
By formula: CO3- + H2O = CH2O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.99 ± 0.84 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
ΔrH° | 48.1 ± 4.2 | kJ/mol | IMRE | Fehsenfeld and Ferguson, 1974 | gas phase; B |
ΔrH° | <161.1 | kJ/mol | PDis | Smith, Lee, et al., 1978 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 27.6 ± 1.7 | kJ/mol | TDAs | Keesee, Lee, et al., 1979 | gas phase; B |
ΔrG° | 28.0 ± 1.7 | kJ/mol | IMRE | Fehsenfeld and Ferguson, 1974 | gas phase; B |
By formula: CO3- + H2O = (CO3- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.0 | kJ/mol | HPMS | Keesee, Lee, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | HPMS | Keesee, Lee, et al., 1979 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: (CO3- • H2O) + H2O = (CO3- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 | kJ/mol | HPMS | Keesee, Lee, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 124. | J/mol*K | HPMS | Keesee, Lee, et al., 1979 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: (CO3- • 2H2O) + H2O = (CO3- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 | kJ/mol | HPMS | Keesee, Lee, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 136. | J/mol*K | HPMS | Keesee, Lee, et al., 1979 | gas phase; M |
By formula: C2Cl3O2- + H2O = (C2Cl3O2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C2F3O2- + H2O = (C2F3O2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 ± 6.3 | kJ/mol | N/A | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 57.3 ± 4.2 | kJ/mol | N/A | Meot-Ner and Sieck, 1986 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 27. ± 6.7 | kJ/mol | TDAs | Meot-Ner and Sieck, 1986 | gas phase; B |
By formula: (C2F3O2- • H2O) + H2O = (C2F3O2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C2H- + H2O = (C2H- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 67.8 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 77.8 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 44.4 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
By formula: C2HCl2O2- + H2O = (C2HCl2O2- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
(C2HCl2O2- • ) +
= (C2HCl2O2- • 2
)
By formula: (C2HCl2O2- • H2O) + H2O = (C2HCl2O2- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.8 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C2HF2O2- + H2O = (C2HF2O2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.7 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 31.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
(C2HF2O2- • ) +
= (C2HF2O2- • 2
)
By formula: (C2HF2O2- • H2O) + H2O = (C2HF2O2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C2HO4- + H2O = (C2HO4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C2H2ClO2- + H2O = (C2H2ClO2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 32.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C2H2FO2- + H2O = (C2H2FO2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 34.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C2H2FO2- • H2O) + H2O = (C2H2FO2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 24.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C2H2FO2- • 2H2O) + H2O = (C2H2FO2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C2H2F3O2+ + H2O = (C2H2F3O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 118. | kJ/mol | ICR | Larson and McMahon, 1982 | gas phase; From thermochemical cycle(H3O+)H2O, Entropy change calculated or estimated; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984, Keesee and Castleman, 1986; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.5 | J/mol*K | N/A | Larson and McMahon, 1982 | gas phase; From thermochemical cycle(H3O+)H2O, Entropy change calculated or estimated; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984, Keesee and Castleman, 1986; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
89.5 | 309. | ICR | Larson and McMahon, 1982 | gas phase; From thermochemical cycle(H3O+)H2O, Entropy change calculated or estimated; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984, Keesee and Castleman, 1986; M |
By formula: C2H2IO2- + H2O = (C2H2IO2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.4 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 30.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C2H2IO2- • H2O) + H2O = (C2H2IO2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C2H2IO2- • 2H2O) + H2O = (C2H2IO2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.3 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C2H2N- + H2O = (C2H2N- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 73.6 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 33. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
By formula: C2H2O+ + H2O = (C2H2O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 | kJ/mol | EI | Postma, Ruttink, et al., 1986 | gas phase; based on AE(CH2CO+)H2O from (HOCH2)2CO+; M |
By formula: C2H3O+ + H2O = (C2H3O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 103. | kJ/mol | HPMS | Davidson, Lau, et al., 1978 | gas phase; forms CH3COOH2+; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 138. | J/mol*K | HPMS | Davidson, Lau, et al., 1978 | gas phase; forms CH3COOH2+; M |
By formula: C2H3O- + H2O = (C2H3O- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.4 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 81.6 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 40. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
By formula: (C2H3O2- • C6H11NO3) + H2O = (C2H3O2- • H2O • C6H11NO3)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 106. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
By formula: C2H3O2- + H2O = (C2H3O2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.6 ± 3.3 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
ΔrH° | 66.5 ± 4.2 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
ΔrH° | 66.9 ± 4.2 | kJ/mol | N/A | Meot-Ner and Sieck, 1986 | gas phase; B,M |
ΔrH° | 68.6 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 66.1 | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.9 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
ΔrS° | 94.1 | J/mol*K | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; ion given as C2H3COO- in paper by error; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 38. ± 5.9 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
ΔrG° | 39.8 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
ΔrG° | 39. ± 6.7 | kJ/mol | TDAs | Meot-Ner and Sieck, 1986 | gas phase; B |
ΔrG° | 39.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C2H3O2- • H2O) + H2O = (C2H3O2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 ± 4.2 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
ΔrH° | 57.7 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 53.6 | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
ΔrH° | 54.0 | kJ/mol | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 79.9 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
ΔrS° | 85.8 | J/mol*K | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 29.3 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
ΔrG° | 28.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C2H3O2- • 2H2O) + H2O = (C2H3O2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 ± 4.2 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
ΔrH° | 51.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 49.4 | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84. | J/mol*K | N/A | Meot-ner, 1988, 2 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 24.4 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
ΔrG° | 21.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 25. | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; Entropy change calculated or estimated; M |
By formula: C2H4F3O+ + H2O = (C2H4F3O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 128. | kJ/mol | ICR | Larson and McMahon, 1982 | gas phase; switching reaction(H3O+)H2O, Entropy change calculated or estimated; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984, Keesee and Castleman, 1986; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.6 | J/mol*K | N/A | Larson and McMahon, 1982 | gas phase; switching reaction(H3O+)H2O, Entropy change calculated or estimated; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984, Keesee and Castleman, 1986; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
97.9 | 309. | ICR | Larson and McMahon, 1982 | gas phase; switching reaction(H3O+)H2O, Entropy change calculated or estimated; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984, Keesee and Castleman, 1986; M |
By formula: (C2H4N+ • C2H3N) + H2O = (C2H4N+ • H2O • C2H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 66.5 | kJ/mol | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n; M |
By formula: C2H4N+ + H2O = (C2H4N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 92.5 ± 5.9 | kJ/mol | CID | Honma, Sunderlin, et al., 1993 | gas phase; guided ion beam CID; M |
ΔrH° | 95.4 | kJ/mol | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
ΔrH° | 104. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
ΔrS° | 119. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(C2H4N+ • •
) +
= (C2H4N+ • 2
•
)
By formula: (C2H4N+ • H2O • C2H3N) + H2O = (C2H4N+ • 2H2O • C2H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.0 | kJ/mol | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n; M |
(C2H4N+ • • 2
) +
= (C2H4N+ • 2
• 2
)
By formula: (C2H4N+ • H2O • 2C2H3N) + H2O = (C2H4N+ • 2H2O • 2C2H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12. | 316. | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n, Entropy change calculated or estimated; M |
(C2H4N+ • 2 •
) +
= (C2H4N+ • 3
•
)
By formula: (C2H4N+ • 2H2O • C2H3N) + H2O = (C2H4N+ • 3H2O • C2H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 | kJ/mol | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 93.3 | J/mol*K | PHPMS | Deakyne, Meot-Ner (Mautner), et al., 1986 | gas phase; n; M |
By formula: (C2H4N+ • H2O) + H2O = (C2H4N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 62.8 ± 7.1 | kJ/mol | CID | Honma, Sunderlin, et al., 1993 | gas phase; guided ion beam CID; M |
ΔrH° | 73.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H4N+ • 2H2O) + H2O = (C2H4N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H4N+ • 3H2O) + H2O = (C2H4N+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.2 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H4N+ • 4H2O) + H2O = (C2H4N+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.9 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H4N+ • 5H2O) + H2O = (C2H4N+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 107. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: C2H4NO2- + H2O = C2H6NO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.5 ± 2.1 | kJ/mol | TDAs | Nieckarz, Atkins, et al., 2008 | gas phase; B |
ΔrH° | 66.9 ± 1.3 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 39. ± 4.2 | kJ/mol | TDAs | Nieckarz, Atkins, et al., 2008 | gas phase; B |
ΔrG° | 34.3 ± 1.7 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C2H4NO5- + H2O + C2H4O2 = C2H6NO6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 19.2 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: C2H5F2O+ + H2O = (C2H5F2O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 100. | kJ/mol | ICR | Berman and Beauchamp, 1986 | gas phase; bracketing; Lias, Liebman, et al., 1984; M |
By formula: C2H5F3N+ + H2O = (C2H5F3N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 88.3 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 126. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
(C2H5F3N+ • ) +
= (C2H5F3N+ • 2
)
By formula: (C2H5F3N+ • H2O) + H2O = (C2H5F3N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.4 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 125. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
(C2H5F3N+ • 2) +
= (C2H5F3N+ • 3
)
By formula: (C2H5F3N+ • 2H2O) + H2O = (C2H5F3N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.4 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 122. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
By formula: C2H5O+ + H2O = (C2H5O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 105. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 115. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • H2O) + H2O = (C2H5O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • 2H2O) + H2O = (C2H5O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 71.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 117. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • 3H2O) + H2O = (C2H5O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.5 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • 4H2O) + H2O = (C2H5O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.7 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • 5H2O) + H2O = (C2H5O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.8 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • 6H2O) + H2O = (C2H5O+ • 7H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: C2H5O+ + H2O = (C2H5O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 84.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 91.6 | kJ/mol | HPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.9 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • H2O) + H2O = (C2H5O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • 2H2O) + H2O = (C2H5O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.1 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H5O+ • 3H2O) + H2O = (C2H5O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 85.4 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: C2H5O2+ + H2O = (C2H5O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 90.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(C2H5O2+ • ) +
= (C2H5O2+ • 2
)
By formula: (C2H5O2+ • H2O) + H2O = (C2H5O2+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 67.8 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 111. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(C2H5O2+ • 2) +
= (C2H5O2+ • 3
)
By formula: (C2H5O2+ • 2H2O) + H2O = (C2H5O2+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.5 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(C2H5O2+ • 3) +
= (C2H5O2+ • 4
)
By formula: (C2H5O2+ • 3H2O) + H2O = (C2H5O2+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.4 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16. | 334. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
(C2H5O2+ • 4) +
= (C2H5O2+ • 5
)
By formula: (C2H5O2+ • 4H2O) + H2O = (C2H5O2+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.7 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
17. | 280. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: C2H5O4- + 2H2O = C2H7O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C2H6NO2+ + H2O = (C2H6NO2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
41. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C2H6NO2+ • ) +
= (C2H6NO2+ • 2
)
By formula: (C2H6NO2+ • H2O) + H2O = (C2H6NO2+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C2H6NO2+ • 2) +
= (C2H6NO2+ • 3
)
By formula: (C2H6NO2+ • 2H2O) + H2O = (C2H6NO2+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: (C2H7O+ • C2H6O) + H2O = (C2H7O+ • H2O • C2H6O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.2 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n, Entropy change is questionable; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 162. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n, Entropy change is questionable; M |
By formula: C2H7O+ + H2O = (C2H7O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.9 | kJ/mol | PHPMS | Tholman, Tonner, et al., 1994 | gas phase; M |
ΔrH° | 100. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 94.6 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 114. | J/mol*K | PHPMS | Tholman, Tonner, et al., 1994 | gas phase; M |
ΔrS° | 121. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 111. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; M |
(C2H7O+ • •
) +
= (C2H7O+ • 2
•
)
By formula: (C2H7O+ • H2O • C2H6O) + H2O = (C2H7O+ • 2H2O • C2H6O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
(C2H7O+ • • 2
) +
= (C2H7O+ • 2
• 2
)
By formula: (C2H7O+ • H2O • 2C2H6O) + H2O = (C2H7O+ • 2H2O • 2C2H6O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 127. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
(C2H7O+ • • 3
) +
= (C2H7O+ • 2
• 3
)
By formula: (C2H7O+ • H2O • 3C2H6O) + H2O = (C2H7O+ • 2H2O • 3C2H6O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 127. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
(C2H7O+ • 2 •
) +
= (C2H7O+ • 3
•
)
By formula: (C2H7O+ • 2H2O • C2H6O) + H2O = (C2H7O+ • 3H2O • C2H6O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 112. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
By formula: (C2H7O+ • H2O) + H2O = (C2H7O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.0 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
By formula: (C2H7O+ • 2H2O) + H2O = (C2H7O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 | kJ/mol | PHPMS | Tholman, Tonner, et al., 1994 | gas phase; M |
ΔrH° | 57.7 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.0 | J/mol*K | PHPMS | Tholman, Tonner, et al., 1994 | gas phase; M |
ΔrS° | 106. | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
By formula: (C2H7O+ • 3H2O) + H2O = (C2H7O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.7 | kJ/mol | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 79.5 | J/mol*K | PHPMS | Hiraoka, Grimsrud, et al., 1974 | gas phase; n; M |
By formula: C2H7O+ + H2O = (C2H7O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 111. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 100. | kJ/mol | PHPMS | Kebarle, 1977 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 128. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Kebarle, 1977 | gas phase; M |
By formula: (C2H7O+ • H2O) + H2O = (C2H7O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 78.2 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 80.3 | kJ/mol | PHPMS | Kebarle, 1977 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 120. | J/mol*K | PHPMS | Kebarle, 1977 | gas phase; M |
By formula: (C2H7O+ • 2H2O) + H2O = (C2H7O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.1 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 59.4 | kJ/mol | PHPMS | Kebarle, 1977 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Kebarle, 1977 | gas phase; M |
By formula: (C2H7O+ • 3H2O) + H2O = (C2H7O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.3 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 52.3 | kJ/mol | PHPMS | Kebarle, 1977 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.4 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Kebarle, 1977 | gas phase; M |
By formula: (C2H7O+ • 4H2O) + H2O = (C2H7O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.4 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C2H7O+ • 5H2O) + H2O = (C2H7O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 | kJ/mol | PHPMS | Kebarle, 1977 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | PHPMS | Kebarle, 1977 | gas phase; M |
By formula: C2H7O2- + H2O + CH4O = C2H9O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.5 ± 4.2 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 42.3 ± 2.1 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
By formula: C2H7O5- + 3H2O = C2H9O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C2H7O5S- + 2H2O = C2H9O6S-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C2H7S+ + H2O = (C2H7S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50. | kJ/mol | ICR | Berman and Beauchamp, 1986 | gas phase; bracketing; Lias, Liebman, et al., 1984; M |
ΔrH° | 54.8 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.6 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
By formula: (C2H7S+ • H2O) + H2O = (C2H7S+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.2 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
By formula: C2H7S+ + H2O = (C2H7S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.5 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.4 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
By formula: C2H8N+ + H2O = (C2H8N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 62.8 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.8 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 38. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (C2H8N+ • H2O) + H2O = (C2H8N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (C2H8N+ • 2H2O) + H2O = (C2H8N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (C2H8N+ • 3H2O) + H2O = (C2H8N+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H8N+ • 4H2O) + H2O = (C2H8N+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C2H8N+ • 5H2O) + H2O = (C2H8N+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 35. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.7 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 255. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: C2H8N+ + H2O = (C2H8N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73.2 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
By formula: (C2H8N+ • H2O) + H2O = (C2H8N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.5 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 124. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
By formula: (C2H8N+ • 2H2O) + H2O = (C2H8N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 | kJ/mol | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 129. | J/mol*K | PHPMS | Lau and Kebarle, 1981 | gas phase; M |
C2H8O8S2-2 + 3 = C2H10O9S2-2
By formula: C2H8O8S2-2 + 3H2O = C2H10O9S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C2H9N+ + H2O = (C2H9N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C2H9O3- + 2H2O + CH4O = C2H11O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.6 ± 4.2 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28.9 ± 2.1 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
C2H10O9S2-2 + 4 = C2H12O10S2-2
By formula: C2H10O9S2-2 + 4H2O = C2H12O10S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 27.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C2H12O10S2-2 + 5 = C2H14O11S2-2
By formula: C2H12O10S2-2 + 5H2O = C2H14O11S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C2H14O11S2-2 + 6 = C2H16O12S2-2
By formula: C2H14O11S2-2 + 6H2O = C2H16O12S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C3H2F3O- + H2O = (C3H2F3O- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.6 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 32. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
By formula: C3H2F3O- + H2O = (C3H2F3O- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.6 | kJ/mol | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 72.4 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
By formula: C3H2N+ + H2O = (C3H2N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 97.5 | kJ/mol | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.6 | J/mol*K | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
By formula: C3H2NO2- + H2O = (C3H2NO2- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.83 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 29.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
(C3H2NO2- • ) +
= (C3H2NO2- • 2
)
By formula: (C3H2NO2- • H2O) + H2O = (C3H2NO2- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C3H3N2- + H2O = (C3H3N2- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.6 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.6 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
By formula: (C3H3N2- • H2O) + H2O = (C3H3N2- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 76.1 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
By formula: (C3H3N2- • 2H2O) + H2O = (C3H3N2- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 122. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
By formula: C3H3O4- + H2O = (C3H3O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C3H3O4- • ) +
= (C3H3O4- • 2
)
By formula: (C3H3O4- • H2O) + H2O = (C3H3O4- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 17. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C3H4N2+ + H2O = (C3H4N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.6 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
(C3H4N2+ • ) +
= (C3H4N2+ • 2
)
By formula: (C3H4N2+ • H2O) + H2O = (C3H4N2+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.5 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
(C3H4N2+ • 2) +
= (C3H4N2+ • 3
)
By formula: (C3H4N2+ • 2H2O) + H2O = (C3H4N2+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 125. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1988 | gas phase; M |
By formula: C3H4O5- + H2O + C2H4O2 = C3H6O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 19.2 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: C3H5O+ + H2O = (C3H5O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 66.1 | kJ/mol | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.9 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
By formula: (C3H5O+ • H2O) + H2O = (C3H5O+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 | kJ/mol | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.4 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
By formula: (C3H5O+ • 2H2O) + H2O = (C3H5O+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 115. | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
By formula: (C3H5O+ • 3H2O) + H2O = (C3H5O+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.2 | kJ/mol | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
By formula: C3H5O+ + H2O = (C3H5O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 99.2 | kJ/mol | PHPMS | Davidson, Meza-Hojer, et al., 1979 | gas phase; forms protonated propanoic acid; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 147. | J/mol*K | PHPMS | Davidson, Meza-Hojer, et al., 1979 | gas phase; forms protonated propanoic acid; M |
By formula: (C3H5O+ • 2H2O) + H2O = (C3H5O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.6 | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977 | gas phase; M |
By formula: (C3H5O+ • 3H2O) + H2O = (C3H5O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.1 | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977 | gas phase; M |
By formula: C3H5O- + H2O = (C3H5O- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 66.1 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 41. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
By formula: C3H5O2- + H2O = (C3H5O2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 38.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 35.1 ± 0.84 | kJ/mol | N/A | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: (C3H5O2- • H2O) + H2O = (C3H5O2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 27.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 28.9 ± 0.84 | kJ/mol | N/A | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: (C3H5O2- • 2H2O) + H2O = (C3H5O2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.6 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 21.3 ± 0.84 | kJ/mol | N/A | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: C3H5O3- + H2O = (C3H5O3- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 32.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C3H5O3- • H2O) + H2O = (C3H5O3- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C3H5O3- + H2O = (C3H5O3- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.3 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 36.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C3H5O3- • H2O) + H2O = (C3H5O3- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C3H5O3- • 2H2O) + H2O = (C3H5O3- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C3H5O5- + 2H2O = C3H7O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 16.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C3H6+ + H2O = (C3H6+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | CID | Holmes, Mommers, et al., 1984 | gas phase; structure confirmed as ion-dipole complex in Shao, Baer, et al., 1987; M |
By formula: C3H6NO2- + H2O = C3H8NO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.0 ± 1.7 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 32.6 ± 3.3 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C3H7+ + H2O = (C3H7+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73.6 | kJ/mol | HPMS | Beggs and Field, 1971 | gas phase; ΔrH inconsistent with (CH3)2CHOH2+ product; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 116. | J/mol*K | HPMS | Beggs and Field, 1971 | gas phase; ΔrH inconsistent with (CH3)2CHOH2+ product; M |
By formula: C3H7O+ + H2O = (C3H7O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 85.8 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C3H7O+ • H2O) + H2O = (C3H7O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.1 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C3H7O+ • 2H2O) + H2O = (C3H7O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.6 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C3H7O+ • 3H2O) + H2O = (C3H7O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C3H7O+ • 4H2O) + H2O = (C3H7O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.3 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: C3H7O+ + H2O = (C3H7O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.7 | J/mol*K | PHPMS | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; M |
By formula: C3H9O+ + H2O = (C3H9O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 100. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 117. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • H2O) + H2O = (C3H9O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.9 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 2H2O) + H2O = (C3H9O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 3H2O) + H2O = (C3H9O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.8 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 4H2O) + H2O = (C3H9O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 86.6 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 5H2O) + H2O = (C3H9O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: C3H9O+ + H2O = (C3H9O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.2 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; unusually small ΔrH and ΔrS; M |
ΔrH° | 56.5 | kJ/mol | HPMS | Beggs and Field, 1971 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 57.3 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; unusually small ΔrH and ΔrS; M |
ΔrS° | 53.1 | J/mol*K | HPMS | Beggs and Field, 1971 | gas phase; M |
By formula: (C3H9O+ • H2O) + H2O = (C3H9O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.6 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrH° | 62.3 | kJ/mol | HPMS | Beggs and Field, 1971 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 101. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
ΔrS° | 90.0 | J/mol*K | HPMS | Beggs and Field, 1971 | gas phase; M |
By formula: (C3H9O+ • 2H2O) + H2O = (C3H9O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.3 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.7 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 3H2O) + H2O = (C3H9O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.9 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.0 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 4H2O) + H2O = (C3H9O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.6 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 5H2O) + H2O = (C3H9O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.1 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; M |
By formula: (C3H9O+ • 6H2O) + H2O = (C3H9O+ • 7H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 33. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1986 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84. | J/mol*K | N/A | Hiraoka, Takimoto, et al., 1986 | gas phase; Entropy change calculated or estimated; M |
By formula: C3H9S+ + H2O = (C3H9S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.7 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 347. | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
By formula: C3H9S+ + H2O = (C3H9S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.2 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
17. | 446. | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
By formula: C3H9S+ + H2O = (C3H9S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 418. | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
By formula: C3H9Si+ + H2O = (C3H9Si+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 126. ± 7.9 | kJ/mol | PHPMS | Stone and Wojtyniak, 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | PHPMS | Stone and Wojtyniak, 1986 | gas phase; M |
(C3H9Si+ • ) +
= (C3H9Si+ • 2
)
By formula: (C3H9Si+ • H2O) + H2O = (C3H9Si+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 83.3 | kJ/mol | PHPMS | Stone and Wytenberg, 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 118. | J/mol*K | PHPMS | Stone and Wytenberg, 1987 | gas phase; M |
By formula: C3H9Sn+ + H2O = (C3H9Sn+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 108. | kJ/mol | PHPMS | Stone and Splinter, 1984 | gas phase; switching reaction((CH3)3Sn+)CH3OH; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 115. | J/mol*K | N/A | Stone and Splinter, 1984 | gas phase; switching reaction((CH3)3Sn+)CH3OH; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
46.9 | 525. | PHPMS | Stone and Splinter, 1984 | gas phase; switching reaction((CH3)3Sn+)CH3OH; Entropy change calculated or estimated; M |
(C3H10N+ • 2) +
= (C3H10N+ •
• 2
)
By formula: (C3H10N+ • 2C3H9N) + H2O = (C3H10N+ • H2O • 2C3H9N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. | kJ/mol | PHPMS | El-Shall, Daly, et al., 1992 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | El-Shall, Daly, et al., 1992 | gas phase; M |
By formula: C3H10N+ + H2O = (C3H10N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.7 | kJ/mol | PHPMS | El-Shall, Daly, et al., 1992 | gas phase; M |
ΔrH° | 60.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 60.7 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | El-Shall, Daly, et al., 1992 | gas phase; M |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 32. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
(C3H10N+ • •
) +
= (C3H10N+ • 2
•
)
By formula: (C3H10N+ • H2O • C3H9N) + H2O = (C3H10N+ • 2H2O • C3H9N)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 34. | kJ/mol | PHPMS | El-Shall, Daly, et al., 1992 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | El-Shall, Daly, et al., 1992 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
10. | 225. | PHPMS | El-Shall, Daly, et al., 1992 | gas phase; Entropy change calculated or estimated; M |
(C3H10N+ • ) +
= (C3H10N+ • 2
)
By formula: (C3H10N+ • H2O) + H2O = (C3H10N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
(C3H10N+ • 2) +
= (C3H10N+ • 3
)
By formula: (C3H10N+ • 2H2O) + H2O = (C3H10N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 14. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
(C3H10N+ • 3) +
= (C3H10N+ • 4
)
By formula: (C3H10N+ • 3H2O) + H2O = (C3H10N+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 35. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated, attributed to MeNH3+.4H2O by error in footnote; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.4 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated, attributed to MeNH3+.4H2O by error in footnote; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 254. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated, attributed to MeNH3+.4H2O by error in footnote; M |
By formula: C3H10N+ + H2O = (C3H10N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.3 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
ΔrH° | 63.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.4 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
ΔrS° | 90.0 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 37. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C3H10N+ • ) +
= (C3H10N+ • 2
)
By formula: (C3H10N+ • H2O) + H2O = (C3H10N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.1 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
27. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C3H10N+ • 2) +
= (C3H10N+ • 3
)
By formula: (C3H10N+ • 2H2O) + H2O = (C3H10N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.7 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C3H10N+ • 3) +
= (C3H10N+ • 4
)
By formula: (C3H10N+ • 3H2O) + H2O = (C3H10N+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: C3H11N2+ + H2O = (C3H11N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
26. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C3H11O3- + H2O + 2CH4O = C3H13O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 ± 4.2 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26.8 ± 2.1 | kJ/mol | TDAs | Meot-Ner(Mautner), 1986 | gas phase; B |
By formula: C4H3O4- + H2O = (C4H3O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C4H3O4- + H2O = (C4H3O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C4H4N- + H2O = (C4H4N- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.7 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.7 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 37. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
By formula: (C4H4N- • H2O) + H2O = (C4H4N- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.6 | kJ/mol | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.1 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
By formula: C4H4O+ + H2O = (C4H4O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 74.5 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C4H4S+ + H2O = (C4H4S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 74.1 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C4H5N+ + H2O = (C4H5N+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 64.9 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: (C4H5N+ • H2O) + H2O = (C4H5N+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 36. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 63. | J/mol*K | N/A | Hiraoka, Takimoto, et al., 1987 | gas phase; Entropy change calculated or estimated; M |
By formula: C4H5O+ + H2O = (C4H5O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrH° | 42.7 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
ΔrH° | 67. | kJ/mol | PHPMS | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; Entropy change calculated or estimated, ΔrH<; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84. | J/mol*K | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrS° | 82.4 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
ΔrS° | 130. | J/mol*K | N/A | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; Entropy change calculated or estimated, ΔrH<; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 382. | PHPMS | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; Entropy change calculated or estimated, ΔrH<; M |
By formula: C4H5O4- + H2O = (C4H5O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C4H5O4- • ) +
= (C4H5O4- • 2
)
By formula: (C4H5O4- • H2O) + H2O = (C4H5O4- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 17. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C4H5O5- + 2H2O = C4H7O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C4H5S+ + H2O = (C4H5S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrH° | 42.7 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 86.2 | J/mol*K | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrS° | 83.3 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C4H6N+ + H2O = (C4H6N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.6 | kJ/mol | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrH° | 57.7 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
ΔrH° | 67. | kJ/mol | PHPMS | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; Entropy change calculated or estimated, ΔrH<; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.5 | J/mol*K | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrS° | 92.0 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
ΔrS° | 130. | J/mol*K | N/A | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; Entropy change calculated or estimated, ΔrH<; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 344. | PHPMS | Meot-Ner (Mautner), Ross, et al., 1985 | gas phase; Entropy change calculated or estimated, ΔrH<; M |
By formula: (C4H6N+ • H2O) + H2O = (C4H6N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrH° | 45.6 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.6 | J/mol*K | PHPMS | Nicol, Sunner, et al., 1988 | gas phase; M |
ΔrS° | 99.2 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C4H7N2O3- + H2O = C4H9N2O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 ± 2.1 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. ± 4.6 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C4H7O2- + H2O = C4H9O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 36.0 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: C4H7O2- + H2O = (C4H7O2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.7 ± 4.2 | kJ/mol | N/A | Meot-Ner and Sieck, 1986 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Meot-Ner and Sieck, 1986 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 37. ± 6.7 | kJ/mol | IMRE | Meot-Ner and Sieck, 1986 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16. | 514. | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; Entropy change calculated or estimated; M |
By formula: C4H7O4- + H2O + 2H2O = C4H9O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 ± 2.9 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21.7 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
By formula: C4H7O5- + 2H2O = C4H9O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 16.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C4H8N+ + H2O = (C4H8N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 80.3 | kJ/mol | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
By formula: C4H8N+ + H2O = (C4H8N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 100. | kJ/mol | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 131. | J/mol*K | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
By formula: C4H8S+ + H2O = (C4H8S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42. | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; ΔrH<; M |
By formula: C4H9+ + H2O = (C4H9+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; M |
By formula: (C4H9+ • 2H2O) + H2O = (C4H9+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.1 | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; may form ((CH3)3COH2+) 2H2O; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; may form ((CH3)3COH2+) 2H2O; M |
By formula: (C4H9+ • 3H2O) + H2O = (C4H9+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59. | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977, 3 | gas phase; may form ((CH3)3COH2+) 3H2O; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 3 | gas phase; may form ((CH3)3COH2+) 3H2O; M |
By formula: C4H9O+ + H2O = (C4H9O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 82.8 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: (C4H9O+ • H2O) + H2O = (C4H9O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C4H9O- + H2O = (C4H9O- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 97.9 ± 4.2 | kJ/mol | IMRE | Meot-Ner and Sieck, 1986 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | N/A | Meot-Ner and Sieck, 1986 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 62.8 ± 7.9 | kJ/mol | IMRE | Meot-Ner and Sieck, 1986 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
39. | 505. | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; Entropy change calculated or estimated; M |
By formula: C4H9O3- + 3H2O = C4H11O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 27.6 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: C4H9O5- + H2O + 3H2O = C4H11O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.4 ± 2.5 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 16.4 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
By formula: C4H9S+ + H2O = (C4H9S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.1 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 81.6 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: (C4H9S+ • H2O) + H2O = (C4H9S+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.9 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C4H10N+ + H2O = (C4H10N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.3 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.3 | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
(C4H10N+ • ) +
= (C4H10N+ • 2
)
By formula: (C4H10N+ • H2O) + H2O = (C4H10N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C4H10NO+ + H2O = (C4H10NO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 69.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 69.0 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
(C4H10NO+ • ) +
= (C4H10NO+ • 2
)
By formula: (C4H10NO+ • H2O) + H2O = (C4H10NO+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 51.5 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 110. | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
(C4H10NO+ • 2) +
= (C4H10NO+ • 3
)
By formula: (C4H10NO+ • 2H2O) + H2O = (C4H10NO+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 80.3 | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
(C4H10NO+ • 3) +
= (C4H10NO+ • 4
)
By formula: (C4H10NO+ • 3H2O) + H2O = (C4H10NO+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.4 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
14. | 268. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
(C4H11O2+ • ) +
= (C4H11O2+ •
•
)
By formula: (C4H11O2+ • C4H10O2) + H2O = (C4H11O2+ • H2O • C4H10O2)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 115. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
By formula: C4H11O2+ + H2O = (C4H11O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.6 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C4H11O2+ • •
) +
= (C4H11O2+ • 2
•
)
By formula: (C4H11O2+ • H2O • C4H10O2) + H2O = (C4H11O2+ • 2H2O • C4H10O2)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C4H11O2+ • • 2
) +
= (C4H11O2+ • 2
• 2
)
By formula: (C4H11O2+ • H2O • 2C4H10O2) + H2O = (C4H11O2+ • 2H2O • 2C4H10O2)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C4H11O2+ • 2 •
) +
= (C4H11O2+ • 3
•
)
By formula: (C4H11O2+ • 2H2O • C4H10O2) + H2O = (C4H11O2+ • 3H2O • C4H10O2)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C4H11O2+ • 2 • 2
) +
= (C4H11O2+ • 3
• 2
)
By formula: (C4H11O2+ • 2H2O • 2C4H10O2) + H2O = (C4H11O2+ • 3H2O • 2C4H10O2)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | N/A | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 225. | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
(C4H11O2+ • 3 •
) +
= (C4H11O2+ • 4
•
)
By formula: (C4H11O2+ • 3H2O • C4H10O2) + H2O = (C4H11O2+ • 4H2O • C4H10O2)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | N/A | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16. | 225. | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
(C4H11O2+ • ) +
= (C4H11O2+ • 2
)
By formula: (C4H11O2+ • H2O) + H2O = (C4H11O2+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C4H11O2+ • 2) +
= (C4H11O2+ • 3
)
By formula: (C4H11O2+ • 2H2O) + H2O = (C4H11O2+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.1 | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C4H11O2+ • 3) +
= (C4H11O2+ • 4
)
By formula: (C4H11O2+ • 3H2O) + H2O = (C4H11O2+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C4H11O2+ • 4) +
= (C4H11O2+ • 5
)
By formula: (C4H11O2+ • 4H2O) + H2O = (C4H11O2+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
By formula: C4H11O4- + 3H2O = C4H13O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21.3 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: C4H11O6- + H2O + 3H2O = C4H13O7-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 ± 4.2 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18.6 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
By formula: C4H13N2+ + H2O = (C4H13N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C5H5- + H2O = (C5H5- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 67.4 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988 | gas phase; B |
By formula: (C5H5- • H2O) + H2O = (C5H5- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | PHPMS | Meot-ner, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 72.8 | J/mol*K | PHPMS | Meot-ner, 1988 | gas phase; M |
By formula: C5H5ClN+ + H2O = (C5H5ClN+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 400. | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C5H5N2O2+ + H2O = (C5H5N2O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 400. | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C5H6N+ + H2O = (C5H6N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 67.4 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
ΔrH° | 62.8 | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
ΔrS° | 107. | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: (C5H6N+ • H2O) + H2O = (C5H6N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.0 | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: (C5H6N+ • 2H2O) + H2O = (C5H6N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 35. | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.0 | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C5H6O4-2 + H2O = (C5H6O4-2 • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 34. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
(C5H6O4-2 • ) +
= (C5H6O4-2 • 2
)
By formula: (C5H6O4-2 • H2O) + H2O = (C5H6O4-2 • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
By formula: C5H7O4- + H2O = (C5H7O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 35. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C5H7O4- • ) +
= (C5H7O4- • 2
)
By formula: (C5H7O4- • H2O) + H2O = (C5H7O4- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C5H7O4- • ) +
= (C5H7O4- • 2
)
By formula: (C5H7O4- • H2O) + H2O = (C5H7O4- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C5H7O4-2 + H2O = C5H9O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C5H8NO2- + H2O = C5H10NO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.4 ± 2.1 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 31.8 ± 3.8 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
C5H9N2O3- + = C5H11N2O4-
By formula: C5H9N2O3- + H2O = C5H11N2O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.2 ± 1.7 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22.6 ± 3.3 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C5H9O+ + H2O = (C5H9O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 76.1 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 112. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C5H9O+ • H2O) + H2O = (C5H9O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C5H9O+ • 2H2O) + H2O = (C5H9O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 80.8 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (C5H9O+ • 3H2O) + H2O = (C5H9O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.3 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
17. | 284. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: (C5H9O+ • 4H2O) + H2O = (C5H9O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.2 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 281. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: C5H9O5- + 2H2O = C5H11O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C5H9O5- + 2H2O = C5H11O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 17.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C5H10NO2+ + H2O = (C5H10NO2+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 79.1 | kJ/mol | PHPMS | Meot-Ner and Field, 1974 | gas phase; Entropy change is questionable; M |
ΔrH° | 79.1 | kJ/mol | PHPMS | Meot-Ner and Field, 1974 | gas phase; Entropy change is questionable; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 154. | J/mol*K | PHPMS | Meot-Ner and Field, 1974 | gas phase; Entropy change is questionable; M |
ΔrS° | 154. | J/mol*K | PHPMS | Meot-Ner and Field, 1974 | gas phase; Entropy change is questionable; M |
By formula: C5H10NO2- + H2O = C5H12NO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.8 ± 1.7 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 30.1 ± 2.9 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
+
= C5H12NO3S-
By formula: C5H10NO2S- + H2O = C5H12NO3S-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.7 ± 2.1 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 29.7 ± 3.3 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C5H11O+ + H2O = (C5H11O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 77.4 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
(C5H11O+ • ) +
= (C5H11O+ • 2
)
By formula: (C5H11O+ • H2O) + H2O = (C5H11O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 | kJ/mol | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Hiraoka, Takimoto, et al., 1987 | gas phase; M |
By formula: C5H12NO2+ + H2O = (C5H12NO2+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 80.8 | kJ/mol | PHPMS | Meot-Ner and Field, 1974 | gas phase; Entropy change is questionable; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 152. | J/mol*K | PHPMS | Meot-Ner and Field, 1974 | gas phase; Entropy change is questionable; M |
By formula: C5H15N2+ + H2O = (C5H15N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C5H16N2+2 + H2O = (C5H16N2+2 • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 77.8 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.0 | J/mol*K | N/A | Blades, Klassen, et al., 1996 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 51.0 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; Entropy change calculated or estimated; M |
(C5H16N2+2 • ) +
= (C5H16N2+2 • 2
)
By formula: (C5H16N2+2 • H2O) + H2O = (C5H16N2+2 • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 77.0 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Blades, Klassen, et al., 1996 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 47.3 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; Entropy change calculated or estimated; M |
By formula: C6F6- + H2O = C6H2F6O-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 22.2 | kJ/mol | N/A | Eustis, Wang, et al., 2007 | gas phase; Vertical Detachment Energy: 1.78±0.02 eV. EA is not adiabatic, just threshhold; B |
By formula: C6H2F6O- + 2H2O = C6H4F6O2-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 14.5 | kJ/mol | N/A | Eustis, Wang, et al., 2007 | gas phase; Vertical Detachment Energy: 1.93±0.03 eV. EA is not adiabatic, just threshhold; B |
By formula: C6H5NO2- + H2O = (C6H5NO2- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.48 ± 0.42 | kJ/mol | TDAs | Sieck, 1985 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.6 | J/mol*K | PHPMS | Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 29.3 ± 0.84 | kJ/mol | TDAs | Sieck, 1985 | gas phase; B |
(C6H5NO2- • ) +
= (C6H5NO2- • 2
)
By formula: (C6H5NO2- • H2O) + H2O = (C6H5NO2- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.88 ± 0.42 | kJ/mol | TDAs | Sieck, 1985 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.9 ± 1.7 | kJ/mol | TDAs | Sieck, 1985 | gas phase; B |
By formula: C6H5N2+ + H2O = (C6H5N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 400. | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C6H5N2+ + H2O = (C6H5N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 66.9 | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
(C6H5N2+ • ) +
= (C6H5N2+ • 2
)
By formula: (C6H5N2+ • H2O) + H2O = (C6H5N2+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
(C6H5N2+ • 2) +
= (C6H5N2+ • 3
)
By formula: (C6H5N2+ • 2H2O) + H2O = (C6H5N2+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
(C6H5N2+ • 3) +
= (C6H5N2+ • 4
)
By formula: (C6H5N2+ • 3H2O) + H2O = (C6H5N2+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 34. | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.4 | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C6H5O- + H2O = (C6H5O- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.4 | kJ/mol | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Meot-Ner and Sieck, 1986 | gas phase; M |
+
= C6H7O2-
By formula: C6H5O- + H2O = C6H7O2-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.4 ± 4.2 | kJ/mol | N/A | Meot-Ner and Sieck, 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 34. ± 6.7 | kJ/mol | TDAs | Meot-Ner and Sieck, 1986 | gas phase; B |
By formula: C6H5S- + H2O = (C6H5S- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 | kJ/mol | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.0 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
+
= C6H7OS-
By formula: C6H5S- + H2O = C6H7OS-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.70 ± 0.84 | kJ/mol | TDAs | Sieck and Meot-ner, 1989 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 23.4 ± 2.9 | kJ/mol | TDAs | Sieck and Meot-ner, 1989 | gas phase; B |
By formula: C6H6ClO+ + H2O = (C6H6ClO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12. | 436. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H6ClO+ + H2O = (C6H6ClO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
20. | 443. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H6ClO+ + H2O = (C6H6ClO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
26. | 453. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H6NO3+ + H2O = (C6H6NO3+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 427. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H6NO3+ + H2O = (C6H6NO3+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 427. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H6NO3+ + H2O = (C6H6NO3+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 427. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H7+ + H2O = (C6H7+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 71. | kJ/mol | ICR | Berman and Beauchamp, 1986 | gas phase; switching reaction(H3O+)H2O, ΔrH<; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984; M |
By formula: C6H7ClN+ + H2O = (C6H7ClN+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.9 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C6H7FN+ + H2O = (C6H7FN+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.9 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C6H7O2+ + H2O = (C6H7O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12. | 454. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H7O2+ + H2O = (C6H7O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 454. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C6H7O4S- + 2H2O = C6H9O5S-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C6H8N+ + H2O = (C6H8N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.5 | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 111. | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C6H8N+ + H2O = (C6H8N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.2 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 434. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C6H8NO+ + H2O = (C6H8NO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
14. | 400. | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C6H8NO+ + H2O = (C6H8NO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.3 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C6H8O4-2 + H2O = (C6H8O4-2 • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 30. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
(C6H8O4-2 • ) +
= (C6H8O4-2 • 2
)
By formula: (C6H8O4-2 • H2O) + H2O = (C6H8O4-2 • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
(C6H8O4-2 • 2) +
= (C6H8O4-2 • 3
)
By formula: (C6H8O4-2 • 2H2O) + H2O = (C6H8O4-2 • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 35.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C6H8O4-2 • 3) +
= (C6H8O4-2 • 4
)
By formula: (C6H8O4-2 • 3H2O) + H2O = (C6H8O4-2 • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C6H8O4-2 • 4) +
= (C6H8O4-2 • 5
)
By formula: (C6H8O4-2 • 4H2O) + H2O = (C6H8O4-2 • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C6H8O4-2 • 5) +
= (C6H8O4-2 • 6
)
By formula: (C6H8O4-2 • 5H2O) + H2O = (C6H8O4-2 • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
By formula: C6H9N2+ + H2O = (C6H9N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.5 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C6H9N2+ + H2O = (C6H9N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring protonated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring protonated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
2. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring protonated; M |
By formula: C6H9N2+ + H2O = (C6H9N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C6H9O4- + H2O = (C6H9O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C6H9O4- • ) +
= (C6H9O4- • 2
)
By formula: (C6H9O4- • H2O) + H2O = (C6H9O4- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C6H9O4-2 + H2O = C6H11O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C6H11O5- + 2H2O = C6H13O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C6H11O6- + 2H2O + 2H2O = C6H13O7-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38.1 ± 1.7 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 11.6 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
By formula: C6H12NO3+ + H2O = (C6H12NO3+ • H2O)
Bond type: Hydrogen bonds with polydentate bonding in positive ions
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.7 | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
(C6H12NO3+ • ) +
= (C6H12NO3+ • 2
)
By formula: (C6H12NO3+ • H2O) + H2O = (C6H12NO3+ • 2H2O)
Bond type: Hydrogen bonds with polydentate bonding in positive ions
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.9 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
(C6H12NO3+ • 2) +
= (C6H12NO3+ • 3
)
By formula: (C6H12NO3+ • 2H2O) + H2O = (C6H12NO3+ • 3H2O)
Bond type: Hydrogen bonds with polydentate bonding in positive ions
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.0 | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
C6H12N3O4+ + = (C6H12N3O4+ •
)
By formula: C6H12N3O4+ + H2O = (C6H12N3O4+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C6H12N3O4+ • ) +
= (C6H12N3O4+ • 2
)
By formula: (C6H12N3O4+ • H2O) + H2O = (C6H12N3O4+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
24. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
C6H13N2O2- + = C6H15N2O3-
By formula: C6H13N2O2- + H2O = C6H15N2O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.7 ± 2.5 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 30. ± 4.2 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
C6H13N4O2- + = C6H15N4O3-
By formula: C6H13N4O2- + H2O = C6H15N4O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.2 ± 2.1 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22.6 ± 3.8 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C6H13O7- + 2H2O + 2H2O = C6H15O8-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 33.9 ± 0.42 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 9.83 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
By formula: C6H15Ge+ + H2O = (C6H15Ge+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 104. | kJ/mol | PHPMS | Stone and Wytenberg, 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 132. | J/mol*K | PHPMS | Stone and Wytenberg, 1987 | gas phase; M |
(C6H15Ge+ • ) +
= (C6H15Ge+ • 2
)
By formula: (C6H15Ge+ • H2O) + H2O = (C6H15Ge+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 77.0 | kJ/mol | PHPMS | Stone and Wytenberg, 1987 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 137. | J/mol*K | PHPMS | Stone and Wytenberg, 1987 | gas phase; M |
C6H15N2O2+ + = (C6H15N2O2+ •
)
By formula: C6H15N2O2+ + H2O = (C6H15N2O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C6H15O+ + H2O = (C6H15O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 78.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 119. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C6H15O+ • ) +
= (C6H15O+ • 2
)
By formula: (C6H15O+ • H2O) + H2O = (C6H15O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C6H15O+ • 2) +
= (C6H15O+ • 3
)
By formula: (C6H15O+ • 2H2O) + H2O = (C6H15O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C6H15O+ • 3) +
= (C6H15O+ • 4
)
By formula: (C6H15O+ • 3H2O) + H2O = (C6H15O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.2 | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C6H15O+ • 4) +
= (C6H15O+ • 5
)
By formula: (C6H15O+ • 4H2O) + H2O = (C6H15O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 106. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C6H15O+ • 5) +
= (C6H15O+ • 6
)
By formula: (C6H15O+ • 5H2O) + H2O = (C6H15O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | N/A | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 234. | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; Entropy change calculated or estimated; M |
(C6H15O3+ • ) +
= (C6H15O3+ •
•
)
By formula: (C6H15O3+ • C6H14O3) + H2O = (C6H15O3+ • H2O • C6H14O3)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 86.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 145. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
By formula: C6H15O3+ + H2O = (C6H15O3+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73.6 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 146. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C6H15O3+ • ) +
= (C6H15O3+ • 2
)
By formula: (C6H15O3+ • H2O) + H2O = (C6H15O3+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.1 | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; M |
(C6H15O3+ • 2) +
= (C6H15O3+ • 3
)
By formula: (C6H15O3+ • 2H2O) + H2O = (C6H15O3+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.7 | kJ/mol | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; DG<=, ΔrH<=, (ΔrS); M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; DG<=, ΔrH<=, (ΔrS); M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16. | 257. | PHPMS | Meot-Ner (Mautner), Sieck, et al., 1994 | gas phase; DG<=, ΔrH<=, (ΔrS); M |
By formula: C6H15S+ + H2O = (C6H15S+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1985 | gas phase; M |
By formula: C6H16N+ + H2O = (C6H16N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 114. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: C6H16N+ + H2O = (C6H16N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.6 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.4 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 35. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
By formula: C6H17N2+ + H2O = (C6H17N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C6H18N2+2 + H2O = (C6H18N2+2 • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.5 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.9 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 48.1 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C6H18N2+2 • ) +
= (C6H18N2+2 • 2
)
By formula: (C6H18N2+2 • H2O) + H2O = (C6H18N2+2 • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.0 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.7 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 43.5 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
By formula: C7H5O2- + H2O = (C7H5O2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 33.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C7H5O2- • H2O) + H2O = (C7H5O2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.1 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 23.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (C7H5O2- • 2H2O) + H2O = (C7H5O2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.1 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: C7H6N+ + H2O = (C7H6N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 79.1 | kJ/mol | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.7 | J/mol*K | PHPMS | Speller and Meot-Ner (Mautner), 1985 | gas phase; M |
By formula: C7H6NO+ + H2O = (C7H6NO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
32. | 426. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C7H7F3N+ + H2O = (C7H7F3N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 67.4 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C7H7N2+ + H2O = (C7H7N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.4 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; M |
By formula: C7H7O2+ + H2O = (C7H7O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 78.2 | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; data from graph; M |
By formula: C7H7O3+ + H2O = (C7H7O3+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 452. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C7H9O+ + H2O = (C7H9O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 454. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C7H9O+ + H2O = (C7H9O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 447. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C7H9O+ + H2O = (C7H9O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 447. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C7H10N+ + H2O = (C7H10N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: C7H10N+ + H2O = (C7H10N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.5 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; ring to N proton shift on hydration; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; ring to N proton shift on hydration; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
17. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated; ring to N proton shift on hydration; M |
By formula: C7H10NO+ + H2O = (C7H10NO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.1 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring to N proton shift on hydration; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring to N proton shift on hydration; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
3. | 433. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring to N proton shift on hydration; M |
By formula: C7H10O4-2 + H2O = (C7H10O4-2 • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 25. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
(C7H10O4-2 • ) +
= (C7H10O4-2 • 2
)
By formula: (C7H10O4-2 • H2O) + H2O = (C7H10O4-2 • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
(C7H10O4-2 • 2) +
= (C7H10O4-2 • 3
)
By formula: (C7H10O4-2 • 2H2O) + H2O = (C7H10O4-2 • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 33.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C7H10O4-2 • 3) +
= (C7H10O4-2 • 4
)
By formula: (C7H10O4-2 • 3H2O) + H2O = (C7H10O4-2 • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 30.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C7H10O4-2 • 4) +
= (C7H10O4-2 • 5
)
By formula: (C7H10O4-2 • 4H2O) + H2O = (C7H10O4-2 • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C7H10O4-2 • 5) +
= (C7H10O4-2 • 6
)
By formula: (C7H10O4-2 • 5H2O) + H2O = (C7H10O4-2 • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
By formula: C7H11N2+ + H2O = (C7H11N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.2 | kJ/mol | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Davidson, Sunner J., et al., 1979 | gas phase; M |
By formula: C7H11O+ + H2O = (C7H11O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 69.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(C7H11O+ • ) +
= (C7H11O+ • 2
)
By formula: (C7H11O+ • H2O) + H2O = (C7H11O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 93.3 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(C7H11O+ • 2) +
= (C7H11O+ • 3
)
By formula: (C7H11O+ • 2H2O) + H2O = (C7H11O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 71.5 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
(C7H11O+ • 3) +
= (C7H11O+ • 4
)
By formula: (C7H11O+ • 3H2O) + H2O = (C7H11O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 269. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; M |
By formula: C7H11O4-2 + H2O = (C7H11O4-2 • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C7H11O4-2 + H2O = C7H13O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C7H15O2+ + H2O = (C7H15O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 | kJ/mol | HPMS | Field, 1969 | gas phase; Entropy change is questionable; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 50. | J/mol*K | HPMS | Field, 1969 | gas phase; Entropy change is questionable; M |
By formula: C7H17O4S- + 2H2O = C7H19O5S-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C7H19N2+ + H2O = (C7H19N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C7H22+2 + H2O = (C7H22+2 • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.5 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.6 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 46.4 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C7H22+2 • ) +
= (C7H22+2 • 2
)
By formula: (C7H22+2 • H2O) + H2O = (C7H22+2 • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.0 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.2 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 41. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C7H22+2 • 2) +
= (C7H22+2 • 3
)
By formula: (C7H22+2 • 2H2O) + H2O = (C7H22+2 • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C7H22+2 • 3) +
= (C7H22+2 • 4
)
By formula: (C7H22+2 • 3H2O) + H2O = (C7H22+2 • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C7H22+2 • 4) +
= (C7H22+2 • 5
)
By formula: (C7H22+2 • 4H2O) + H2O = (C7H22+2 • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C7H22+2 • 5) +
= (C7H22+2 • 6
)
By formula: (C7H22+2 • 5H2O) + H2O = (C7H22+2 • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C8H4O4- + H2O = (C8H4O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C8H4O4-2 • 2) +
= (C8H4O4-2 • 3
)
By formula: (C8H4O4-2 • 2H2O) + H2O = (C8H4O4-2 • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 35. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C8H4O4-2 • 3) +
= (C8H4O4-2 • 4
)
By formula: (C8H4O4-2 • 3H2O) + H2O = (C8H4O4-2 • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C8H4O4-2 • 4) +
= (C8H4O4-2 • 5
)
By formula: (C8H4O4-2 • 4H2O) + H2O = (C8H4O4-2 • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C8H4O4-2 • 5) +
= (C8H4O4-2 • 6
)
By formula: (C8H4O4-2 • 5H2O) + H2O = (C8H4O4-2 • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C8H5O4- + H2O = (C8H5O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 20. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C8H5O4-2 + H2O = C8H7O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 31.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: C8H10O7-2 + 4H2O = C8H12O8-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 30.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C8H11O+ + H2O = (C8H11O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 455. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C8H11O+ + H2O = (C8H11O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16. | 453. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C8H11O+ + H2O = (C8H11O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 455. | PHPMS | Martinsen and Buttrill, 1978 | gas phase; M |
By formula: C8H12N+ + H2O = (C8H12N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.4 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: C8H12N+ + H2O = (C8H12N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 | kJ/mol | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring to N proton shift on hydration; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring to N proton shift on hydration; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 434. | PHPMS | Lau, Nishizawa, et al., 1981 | gas phase; Entropy change calculated or estimated, ring to N proton shift on hydration; M |
By formula: C8H12N+ + H2O = (C8H12N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.6 | kJ/mol | PHPMS | Buttrill, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88. | J/mol*K | PHPMS | Buttrill, 1983 | gas phase; M |
By formula: C8H12O4-2 + H2O = (C8H12O4-2 • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 28. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 23. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C8H12O4-2 • ) +
= (C8H12O4-2 • 2
)
By formula: (C8H12O4-2 • H2O) + H2O = (C8H12O4-2 • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59. ± 18. | kJ/mol | N/A | Ding, Wang, et al., 1998 | gas phase; Affinity is EA difference from next lower solvated ion.; B |
(C8H12O4-2 • 2) +
= (C8H12O4-2 • 3
)
By formula: (C8H12O4-2 • 2H2O) + H2O = (C8H12O4-2 • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 32.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C8H12O4-2 • 3) +
= (C8H12O4-2 • 4
)
By formula: (C8H12O4-2 • 3H2O) + H2O = (C8H12O4-2 • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 29.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C8H12O4-2 • 4) +
= (C8H12O4-2 • 5
)
By formula: (C8H12O4-2 • 4H2O) + H2O = (C8H12O4-2 • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
(C8H12O4-2 • 5) +
= (C8H12O4-2 • 6
)
By formula: (C8H12O4-2 • 5H2O) + H2O = (C8H12O4-2 • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B,M |
By formula: C8H12O8-2 + 5H2O = C8H14O9-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C8H13O4-2 + H2O = C8H15O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C8H14O9-2 + 6 = C8H16O10-2
By formula: C8H14O9-2 + 6H2O = C8H16O10-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C8H15O8- + 3H2O + H2O = C8H17O9-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. ± 4.2 | kJ/mol | N/A | Meot-ner, Elmore, et al., 1999 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 2.7 | kJ/mol | TDAs | Meot-ner, Elmore, et al., 1999 | gas phase; B |
C8H18N3O3+ + = (C8H18N3O3+ •
)
By formula: C8H18N3O3+ + H2O = (C8H18N3O3+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C8H20N+ + H2O = (C8H20N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
36. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C8H20N+ • ) +
= (C8H20N+ • 2
)
By formula: (C8H20N+ • H2O) + H2O = (C8H20N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
26. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C8H20N+ • 2) +
= (C8H20N+ • 3
)
By formula: (C8H20N+ • 2H2O) + H2O = (C8H20N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C8H21N2+ + H2O = (C8H21N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C8H22N2+2 + H2O = (C8H22N2+2 • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.7 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.0 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 43.9 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C8H22N2+2 • ) +
= (C8H22N2+2 • 2
)
By formula: (C8H22N2+2 • H2O) + H2O = (C8H22N2+2 • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.3 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99.6 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 41. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C8H22N2+2 • 2) +
= (C8H22N2+2 • 3
)
By formula: (C8H22N2+2 • 2H2O) + H2O = (C8H22N2+2 • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
32. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C8H22N2+2 • 3) +
= (C8H22N2+2 • 4
)
By formula: (C8H22N2+2 • 3H2O) + H2O = (C8H22N2+2 • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
29. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C8H22N2+2 • 4) +
= (C8H22N2+2 • 5
)
By formula: (C8H22N2+2 • 4H2O) + H2O = (C8H22N2+2 • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
24. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C8H22N2+2 • 5) +
= (C8H22N2+2 • 6
)
By formula: (C8H22N2+2 • 5H2O) + H2O = (C8H22N2+2 • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C9H10NO2- + H2O = C9H12NO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.7 ± 1.7 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 30.1 ± 3.8 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C9H11O2+ + H2O = (C9H11O2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.3 | kJ/mol | HPMS | Field, 1969 | gas phase; Entropy change is questionable; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 50. | J/mol*K | HPMS | Field, 1969 | gas phase; Entropy change is questionable; M |
By formula: C9H12NO+ + H2O = (C9H12NO+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.2 | kJ/mol | PHPMS | Meot-Ner, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Meot-Ner, 1984 | gas phase; M |
By formula: C9H14N+ + H2O = (C9H14N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.4 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 129. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: C9H14N+ + H2O = (C9H14N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; (H), ΔrS should be 113.6 J/mol*K; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; (H), ΔrS should be 113.6 J/mol*K; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
9.6 | 394. | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; (H), ΔrS should be 113.6 J/mol*K; M |
By formula: C9H14O4-2 + H2O = (C9H14O4-2 • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C9H14O4-2 • 2) +
= (C9H14O4-2 • 3
)
By formula: (C9H14O4-2 • 2H2O) + H2O = (C9H14O4-2 • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 32. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C9H14O4-2 • 3) +
= (C9H14O4-2 • 4
)
By formula: (C9H14O4-2 • 3H2O) + H2O = (C9H14O4-2 • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 29. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C9H14O4-2 • 4) +
= (C9H14O4-2 • 5
)
By formula: (C9H14O4-2 • 4H2O) + H2O = (C9H14O4-2 • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C9H14O4-2 • 5) +
= (C9H14O4-2 • 6
)
By formula: (C9H14O4-2 • 5H2O) + H2O = (C9H14O4-2 • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C9H20O7-2 + 4H2O = C9H22O8-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C9H22N+ + H2O = (C9H22N+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.3 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 126. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: C9H22O8-2 + 5H2O = C9H24O9-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C9H24N2+2 + H2O = (C9H24N2+2 • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 69.0 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 43.1 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C9H24N2+2 • ) +
= (C9H24N2+2 • 2
)
By formula: (C9H24N2+2 • H2O) + H2O = (C9H24N2+2 • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.2 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.9 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 39. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
C9H24O9-2 + 6 = C9H26O10-2
By formula: C9H24O9-2 + 6H2O = C9H26O10-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C10H6O6S2-2 + = (C10H6O6S2-2 •
)
By formula: C10H6O6S2-2 + H2O = (C10H6O6S2-2 • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 33. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C10H6O6S2-2 • ) +
= (C10H6O6S2-2 • 2
)
By formula: (C10H6O6S2-2 • H2O) + H2O = (C10H6O6S2-2 • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 29. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C10H6O6S2-2 • 2) +
= (C10H6O6S2-2 • 3
)
By formula: (C10H6O6S2-2 • 2H2O) + H2O = (C10H6O6S2-2 • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C10H6O6S2-2 • 3) +
= (C10H6O6S2-2 • 4
)
By formula: (C10H6O6S2-2 • 3H2O) + H2O = (C10H6O6S2-2 • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
C10H8O7S2-2 + 2 = C10H10O8S2-2
By formula: C10H8O7S2-2 + 2H2O = C10H10O8S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 29.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C10H10O8S2-2 + 3 = C10H12O9S2-2
By formula: C10H10O8S2-2 + 3H2O = C10H12O9S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C10H12O9S2-2 + 4 = C10H14O10S2-2
By formula: C10H12O9S2-2 + 4H2O = C10H14O10S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
(C10H16O4-2 • 2) +
= (C10H16O4-2 • 3
)
By formula: (C10H16O4-2 • 2H2O) + H2O = (C10H16O4-2 • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C10H16O4-2 • 3) +
= (C10H16O4-2 • 4
)
By formula: (C10H16O4-2 • 3H2O) + H2O = (C10H16O4-2 • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C10H16O4-2 • 4) +
= (C10H16O4-2 • 5
)
By formula: (C10H16O4-2 • 4H2O) + H2O = (C10H16O4-2 • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
(C10H16O4-2 • 5) +
= (C10H16O4-2 • 6
)
By formula: (C10H16O4-2 • 5H2O) + H2O = (C10H16O4-2 • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: C10H17O4- + H2O = (C10H17O4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
C10H19N5O13P2-2 + 4 = C10H21N5O14P2-2
By formula: C10H19N5O13P2-2 + 4H2O = C10H21N5O14P2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25.5 ± 0.84 | kJ/mol | IMRE | Blades, Ho, et al., 1996 | gas phase; Correction to published article: P. Kebarle; B |
By formula: C10H21O5+ + H2O = (C10H21O5+ • H2O)
Bond type: Hydrogen bonds with polydentate bonding in positive ions
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 90.4 | kJ/mol | PHPMS | Sharma and Kebarle, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 138. | J/mol*K | PHPMS | Sharma and Kebarle, 1984 | gas phase; M |
C10H22O7-2 + 4 = C10H24O8-2
By formula: C10H22O7-2 + 4H2O = C10H24O8-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C10H24O8-2 + 5 = C10H26O9-2
By formula: C10H24O8-2 + 5H2O = C10H26O9-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: C10H25N2+ + H2O = (C10H25N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
C10H26N2+2 + = (C10H26N2+2 •
)
By formula: C10H26N2+2 + H2O = (C10H26N2+2 • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.3 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.4 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 43.1 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C10H26N2+2 • ) +
= (C10H26N2+2 • 2
)
By formula: (C10H26N2+2 • H2O) + H2O = (C10H26N2+2 • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.3 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 39. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
(C10H26N2+2 • 2) +
= (C10H26N2+2 • 3
)
By formula: (C10H26N2+2 • 2H2O) + H2O = (C10H26N2+2 • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C10H26N2+2 • 3) +
= (C10H26N2+2 • 4
)
By formula: (C10H26N2+2 • 3H2O) + H2O = (C10H26N2+2 • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C10H26N2+2 • 4) +
= (C10H26N2+2 • 5
)
By formula: (C10H26N2+2 • 4H2O) + H2O = (C10H26N2+2 • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
24. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
(C10H26N2+2 • 5) +
= (C10H26N2+2 • 6
)
By formula: (C10H26N2+2 • 5H2O) + H2O = (C10H26N2+2 • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
C10H26O9-2 + 6 = C10H28O10-2
By formula: C10H26O9-2 + 6H2O = C10H28O10-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
C10H27N5O17P2-2 + 8 = C10H29N5O18P2-2
By formula: C10H27N5O17P2-2 + 8H2O = C10H29N5O18P2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18.4 ± 0.84 | kJ/mol | IMRE | Blades, Ho, et al., 1996 | gas phase; Correction to published article: P. Kebarle; B |
+
= C11H13N2O3-
By formula: C11H11N2O2- + H2O = C11H13N2O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.9 ± 2.1 | kJ/mol | N/A | Wincel, 2008 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28.9 ± 3.8 | kJ/mol | TDAs | Wincel, 2008 | gas phase; B |
By formula: C11H18N+ + H2O = (C11H18N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.6 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 134. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: C12H25O6+ + H2O = (C12H25O6+ • H2O)
Bond type: Hydrogen bonds with polydentate bonding in positive ions
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 110. | kJ/mol | PHPMS | Sharma and Kebarle, 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 145. | J/mol*K | PHPMS | Sharma and Kebarle, 1984 | gas phase; M |
By formula: C12H28N+ + H2O = (C12H28N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 152. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: C12H29N2+ + H2O = (C12H29N2+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: C13H9N- + H2O = C13H11NO-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 27. ± 6.3 | kJ/mol | N/A | Kokubo, Ando, et al., 2004 | gas phase; B |
By formula: C13H22N+ + H2O = (C13H22N+ • H2O)
Bond type: Hydrogen bonds with steric hindrance in positive ions
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.3 | kJ/mol | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 170. | J/mol*K | PHPMS | Meot-Ner M. and Sieck, 1983 | gas phase; M |
By formula: Ca+ + H2O = (Ca+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 120. | kJ/mol | HPMS | Kochanski and Constantin, 1987 | gas phase; M |
By formula: (Ca+ • H2O) + H2O = (Ca+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 100. | kJ/mol | HPMS | Kochanski and Constantin, 1987 | gas phase; M |
By formula: (Ca+ • 2H2O) + H2O = (Ca+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 90.0 | kJ/mol | HPMS | Kochanski and Constantin, 1987 | gas phase; M |
By formula: (Ca+ • 3H2O) + H2O = (Ca+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 78.2 | kJ/mol | HPMS | Kochanski and Constantin, 1987 | gas phase; M |
By formula: (Ca+ • 4H2O) + H2O = (Ca+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73.2 | kJ/mol | HPMS | Kochanski and Constantin, 1987 | gas phase; M |
By formula: (Ca+2 • 8H2O) + H2O = (Ca+2 • 9H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ca+2 • 9H2O) + H2O = (Ca+2 • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
32. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ca+2 • 10H2O) + H2O = (Ca+2 • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ca+2 • 11H2O) + H2O = (Ca+2 • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
29. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Cl- • CH4O) + H2O = (Cl- • H2O • CH4O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.6 | kJ/mol | HPMS | Evans and Keesee, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 70.7 | J/mol*K | HPMS | Evans and Keesee, 1991 | gas phase; M |
By formula: (Cl- • 2CH4O) + H2O = (Cl- • H2O • 2CH4O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 32. | kJ/mol | HPMS | Evans and Keesee, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 46. | J/mol*K | HPMS | Evans and Keesee, 1991 | gas phase; M |
By formula: (Cl- • HCl) + H2O = (Cl- • H2O • HCl)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.9 | kJ/mol | HPMS | Upschulte, Evans, et al., 1986 | gas phase; deuterated, quoted in Keesee and Castleman, 1986; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.2 | J/mol*K | HPMS | Upschulte, Evans, et al., 1986 | gas phase; deuterated, quoted in Keesee and Castleman, 1986; M |
By formula: (Cl- • 2HCl) + H2O = (Cl- • H2O • 2HCl)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 32. | kJ/mol | HPMS | Upschulte, Evans, et al., 1986 | gas phase; deuterated, quoted in Keesee and Castleman, 1986; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 63.6 | J/mol*K | HPMS | Upschulte, Evans, et al., 1986 | gas phase; deuterated, quoted in Keesee and Castleman, 1986; M |
By formula: Cl- + H2O = (Cl- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 20. | kJ/mol | AVG | N/A | Average of 11 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 81. ± 10. | J/mol*K | AVG | N/A | Average of 8 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 40. ± 20. | kJ/mol | AVG | N/A | Average of 9 values; Individual data points |
By formula: (Cl- • H2O • CH4O) + H2O = (Cl- • 2H2O • CH4O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | HPMS | Evans and Keesee, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 64.9 | J/mol*K | HPMS | Evans and Keesee, 1991 | gas phase; M |
By formula: (Cl- • H2O • HCl) + H2O = (Cl- • 2H2O • HCl)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | HPMS | Upschulte, Evans, et al., 1986 | gas phase; deuterated, quoted in 86 KEE/CAS; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 85.4 | J/mol*K | HPMS | Upschulte, Evans, et al., 1986 | gas phase; deuterated, quoted in 86 KEE/CAS; M |
By formula: (Cl- • H2O) + H2O = (Cl- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53. ± 5. | kJ/mol | AVG | N/A | Average of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.5 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 85.8 | J/mol*K | HPMS | Keesee and Castleman, 1980 | gas phase; M |
ΔrS° | 87.0 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28. ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; B |
ΔrG° | 27.2 | kJ/mol | TDAs | Keesee and Castleman, 1980 | gas phase; B |
ΔrG° | 27. ± 5.9 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrG° | 27.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 28. | kJ/mol | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: (Cl- • 2H2O) + H2O = (Cl- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48. ± 7. | kJ/mol | AVG | N/A | Average of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 93.3 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 93.7 | J/mol*K | HPMS | Keesee and Castleman, 1980 | gas phase; M |
ΔrS° | 97.1 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21. ± 2. | kJ/mol | AVG | N/A | Average of 6 values; Individual data points |
By formula: (Cl- • 3H2O) + H2O = (Cl- • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.4 ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; B |
ΔrH° | 40.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 44. ± 1. | kJ/mol | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrH° | 45.6 ± 2.9 | kJ/mol | TDAs | Keesee and Castleman, 1980 | gas phase; B,M |
ΔrH° | 46.4 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.0 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 104. | J/mol*K | HPMS | Keesee and Castleman, 1980 | gas phase; M |
ΔrS° | 108. | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 16. ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; B |
ΔrG° | 14.6 | kJ/mol | TDAs | Keesee and Castleman, 1980 | gas phase; B |
ΔrG° | 14.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 17. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (Cl- • 4H2O) + H2O = (Cl- • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; B |
ΔrH° | 28.0 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 40. ± 1. | kJ/mol | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.8 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 13. ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; B |
ΔrG° | 12. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (Cl- • 5H2O) + H2O = (Cl- • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37. ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; B |
ΔrH° | 35.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 37. ± 2. | kJ/mol | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.7 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 10. ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; B |
By formula: (Cl- • 6H2O) + H2O = (Cl- • 7H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 34. ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; Estimated entropy; single temperature measurement; B |
ΔrH° | 28.9 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 34. | kJ/mol | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84. | J/mol*K | N/A | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 8.8 ± 4.2 | kJ/mol | TDAs | Hiraoka and Mizuse, 1987 | gas phase; Estimated entropy; single temperature measurement; B |
By formula: (Cl- • H2O • O2S) + H2O = (Cl- • 2H2O • O2S)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38.9 | kJ/mol | TDAs | Upschulte, Schelling, et al., 1984 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.4 | J/mol*K | HPMS | Upschulte, Schelling, et al., 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 14.2 | kJ/mol | TDAs | Upschulte, Schelling, et al., 1984 | gas phase; B |
By formula: (Cl- • O2S) + H2O = (Cl- • H2O • O2S)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.51 | kJ/mol | TDAs | Upschulte, Schelling, et al., 1984 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 81.2 | J/mol*K | HPMS | Upschulte, Schelling, et al., 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.2 | kJ/mol | TDAs | Upschulte, Schelling, et al., 1984 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; From thermochemical cycle,switching reaction(H2O/SO2); M |
By formula: (Cl- • 2O2S) + H2O = (Cl- • H2O • 2O2S)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.4 | kJ/mol | TDAs | Upschulte, Schelling, et al., 1984 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.0 | J/mol*K | HPMS | Upschulte, Schelling, et al., 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 13.0 | kJ/mol | TDAs | Upschulte, Schelling, et al., 1984 | gas phase; B |
By formula: ClO2- + H2O = (ClO2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.6 ± 2.1 | kJ/mol | Ther | Tschurl and Boesl, 2007 | gas phase; affinity is difference from ClO2- EA, corrected for calculated neutral BE of 0.09 eV; B |
ΔrH° | 66.9 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 37.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (ClO2- • H2O) + H2O = (ClO2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (ClO2- • 2H2O) + H2O = (ClO2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: ClO3- + H2O = (ClO3- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: (ClO3- • H2O) + H2O = (ClO3- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: ClO3- + H2O = (ClO3- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (ClO3- • H2O) + H2O = (ClO3- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 20. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: ClO4- + H2O = (ClO4- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: Co+ + H2O = (Co+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 160. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
ΔrH° | 168. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
161. (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Co+ • H2O) + H2O = (Co+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 175. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
162. (+7.1,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Co+ • 2H2O) + H2O = (Co+ • 3H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
64.9 (+5.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Co+ • 3H2O) + H2O = (Co+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
58.2 (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Co+2 • 9H2O) + H2O = (Co+2 • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
36. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Co+2 • 10H2O) + H2O = (Co+2 • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
32. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Co+2 • 11H2O) + H2O = (Co+2 • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: Cr+ + H2O = (Cr+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 120. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
ΔrH° | 91.6 | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
129. (+9.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • H2O) + H2O = (Cr+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 123. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
142. (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • 2H2O) + H2O = (Cr+ • 3H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
50. (+50.,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • 3H2O) + H2O = (Cr+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
51.0 (+7.1,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: Cs+ + H2O = (Cs+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.8 | kJ/mol | DT | McKnight and Sawina, 1972 | gas phase; Entropy change is questionable; M |
ΔrH° | 57.3 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 59.8 | J/mol*K | DT | McKnight and Sawina, 1972 | gas phase; Entropy change is questionable; M |
ΔrS° | 81.2 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
By formula: (Cs+ • H2O) + H2O = (Cs+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.3 | kJ/mol | DT | McKnight and Sawina, 1972 | gas phase; Entropy change is questionable; M |
ΔrH° | 52.3 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 69.5 | J/mol*K | DT | McKnight and Sawina, 1972 | gas phase; Entropy change is questionable; M |
ΔrS° | 92.9 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (Cs+ • 2H2O) + H2O = (Cs+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | DT | McKnight and Sawina, 1972 | gas phase; Entropy change is questionable; M |
ΔrH° | 46.9 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 69.5 | J/mol*K | DT | McKnight and Sawina, 1972 | gas phase; Entropy change is questionable; M |
ΔrS° | 99.2 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; From thermochemical cycle,switching reaction, electric fields; M |
By formula: (Cs+ • 3H2O) + H2O = (Cs+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.4 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 106. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
By formula: (Cs+ • H2O • O2S) + H2O = (Cs+ • 2H2O • O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electeric fields; M |
By formula: Cu+ + H2O = (Cu+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.8 | kJ/mol | HPMS | El-Shall, Schriver, et al., 1989 | gas phase; Entropy change calculated or estimated, Cu+ from laser desorption; M |
ΔrH° | 150. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
ΔrH° | 150. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | El-Shall, Schriver, et al., 1989 | gas phase; Entropy change calculated or estimated, Cu+ from laser desorption; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. | kJ/mol | HPMS | El-Shall, Schriver, et al., 1989 | gas phase; Entropy change calculated or estimated, Cu+ from laser desorption; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
157. (+7.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cu+ • H2O) + H2O = (Cu+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 | kJ/mol | HPMS | El-Shall, Schriver, et al., 1989 | gas phase; Entropy change calculated or estimated, Cu+ from laser desorption; M |
ΔrH° | 160. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | El-Shall, Schriver, et al., 1989 | gas phase; Entropy change calculated or estimated, Cu+ from laser desorption; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 27. | kJ/mol | HPMS | El-Shall, Schriver, et al., 1989 | gas phase; Entropy change calculated or estimated, Cu+ from laser desorption; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
170. (+7.1,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cu+ • 2H2O) + H2O = (Cu+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989, 2 | gas phase; M |
ΔrH° | 68.6 | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
56.9 (+7.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cu+ • 3H2O) + H2O = (Cu+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989, 2 | gas phase; M |
ΔrH° | 69.9 | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 126. | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
54.0 (+4.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cu+ • 4H2O) + H2O = (Cu+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.6 | kJ/mol | HPMS | Holland and Castleman, 1982 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 122. | J/mol*K | HPMS | Holland and Castleman, 1982 | gas phase; M |
By formula: F- + H2O = (F- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 114.6 ± 2.1 | kJ/mol | TDAs | Weis, Kemper, et al., 1999 | gas phase; B |
ΔrH° | 97.49 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 72.8 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 91.6 ± 2.1 | kJ/mol | TDAs | Weis, Kemper, et al., 1999 | gas phase; B |
ΔrG° | 75.7 ± 8.4 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
By formula: (F- • H2O) + H2O = (F- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 80.3 ± 2.1 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Stated electron affinity is the Vertical Detachment Energy; B,M |
ΔrH° | 69.5 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrH° | 69.5 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92.9 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 78.2 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 52.3 ± 6.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Stated electron affinity is the Vertical Detachment Energy; B |
ΔrG° | 46.0 ± 5.9 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrG° | 46.02 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
By formula: (F- • 2H2O) + H2O = (F- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.0 ± 1.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 57.3 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrH° | 57.3 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 95.8 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 85.4 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 35. ± 5.4 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 32. ± 5.9 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrG° | 31.8 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
By formula: (F- • 3H2O) + H2O = (F- • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 ± 1.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 56.5 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 111. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 113. | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25. ± 5.4 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 23.0 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 26. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (F- • 4H2O) + H2O = (F- • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 ± 1.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 55.2 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 128. | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19. ± 5.4 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 29.7 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 19. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (F- • 5H2O) + H2O = (F- • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.6 ± 1.3 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 15. ± 4.2 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
By formula: (F- • 6H2O) + H2O = (F- • 7H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 ± 1.3 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 11. ± 4.2 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
By formula: (F- • 7H2O) + H2O = (F- • 8H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 ± 1.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 131. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; 0.4; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 7.5 ± 6.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
By formula: (F- • 8H2O) + H2O = (F- • 9H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.4 ± 2.1 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 137. | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 5.4 ± 8.8 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
By formula: (F- • 9H2O) + H2O = (F- • 10H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.02 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy estimated; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 140. | J/mol*K | N/A | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 4.60 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy estimated; B |
By formula: Fe+ + H2O = (Fe+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 120. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
ΔrH° | 137. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
128. (+5.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • H2O) + H2O = (Fe+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 171. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
164. (+4.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • 2H2O) + H2O = (Fe+ • 3H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
76.1 (+4.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • 3H2O) + H2O = (Fe+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
82.0 (+7.1,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: H- + H2O = (H- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.1 ± 8.4 | kJ/mol | N/A | Miller, Leopold, et al., 1985 | gas phase; EA given is Vertical Detachment Energy. Est. Adiabatic: 1.40 eV, 32.3 kcal/mol; B |
ΔrH° | 72. ± 15. | kJ/mol | Ther | Paulson and Henchman, 1984 | gas phase; HOH..HO- + H2 ->. See also Griffiths and Harris, 1989; B,M |
ΔrH° | 57.74 | kJ/mol | CIDT | Paulson and Henchman, 1982 | gas phase; B |
By formula: HCaO+ + H2O = (HCaO+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 144. | kJ/mol | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.0 | J/mol*K | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
By formula: HO- + H2O = (HO- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 120. ± 30. | kJ/mol | AVG | N/A | Average of 6 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 80.3 ± 4.2 | kJ/mol | TDAs | Paul and Kebarle, 1990 | gas phase; B |
ΔrG° | 84.1 ± 6.7 | kJ/mol | TDEq | Meot-Ner and Sieck, 1986 | gas phase; B |
ΔrG° | 83.7 ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
ΔrG° | 77.82 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
By formula: (HO- • H2O) + H2O = (HO- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73.6 ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
ΔrH° | 74.9 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 46.9 ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
ΔrG° | 48.53 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
By formula: (HO- • 2H2O) + H2O = (HO- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 63.2 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrH° | 67.8 ± 4.2 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 38. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
By formula: (HO- • 3H2O) + H2O = (HO- • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.21 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 24. ± 5.9 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
By formula: (HO- • 4H2O) + H2O = (HO- • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.12 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. ± 5.9 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
By formula: (HO- • 5H2O) + H2O = (HO- • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.86 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. ± 5.9 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
By formula: (HO- • 6H2O) + H2O = (HO- • 7H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.51 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 13. ± 5.9 | kJ/mol | N/A | Meot-Ner (Mautner) and Speller, 1986 | gas phase; B |
By formula: (HO- • 7H2O) + H2O = (HO- • 8H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. ± 4.2 | kJ/mol | TDAs | Meot-Ner (Mautner) and Speller, 1986 | gas phase; Entropy estimated; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 11. ± 5.9 | kJ/mol | TDAs | Meot-Ner (Mautner) and Speller, 1986 | gas phase; Entropy estimated; B |
By formula: HO- + H2O = (HO- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 113. ± 4. | kJ/mol | AVG | N/A | Average of 3 out of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 118. | J/mol*K | PHPMS | Paul and Kebarle, 1990 | gas phase; M |
ΔrS° | 91.2 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrS° | 87.0 | J/mol*K | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
ΔrS° | 79.9 | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
By formula: (HO- • H2O) + H2O = (HO- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73.6 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrH° | 75. | kJ/mol | CID | Hierl and Paulson, 1984 | gas phase; M |
ΔrH° | 74.9 | kJ/mol | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
ΔrH° | 68.6 | kJ/mol | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
ΔrH° | 96. | kJ/mol | CID | DePaz, Giardini, et al., 1970 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.5 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrS° | 88.7 | J/mol*K | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
ΔrS° | 80.8 | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
By formula: (HO- • 2H2O) + H2O = (HO- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 67.8 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrH° | 63.2 | kJ/mol | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
ΔrH° | 75. | kJ/mol | CID | DePaz, Giardini, et al., 1970 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrS° | 104. | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
By formula: (HO- • 3H2O) + H2O = (HO- • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.2 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrH° | 59.4 | kJ/mol | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.3 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrS° | 123. | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 23. | kJ/mol | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: (HO- • 4H2O) + H2O = (HO- • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.1 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrH° | 59.0 | kJ/mol | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 101. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
ΔrS° | 139. | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; deuterated; M |
By formula: (HO- • 5H2O) + H2O = (HO- • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 97.1 | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
By formula: (HO- • 6H2O) + H2O = (HO- • 7H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.5 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
By formula: (HO- • 7H2O) + H2O = (HO- • 8H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16. | 245. | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; deuterated; M |
By formula: HOSr+ + H2O = (HOSr+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 125. | kJ/mol | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.0 | J/mol*K | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
By formula: (HO4S- • HNO3) + H2O = (HO4S- • H2O • HNO3)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 233. | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
By formula: HO4S- + H2O = (HO4S- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (HO4S- • H2O) + H2O = (HO4S- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
(HO4S- • • 3
) +
= (HO4S- • 2
• 3
)
By formula: (HO4S- • H2O • 3H2O4S) + H2O = (HO4S- • 2H2O • 3H2O4S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 233. | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
By formula: (HO4S- • 2H2O4S) + H2O = (HO4S- • H2O • 2H2O4S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.6 | kJ/mol | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
26. | 233. | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
By formula: (HO4S- • 3H2O4S) + H2O = (HO4S- • H2O • 3H2O4S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 | kJ/mol | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 233. | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
By formula: (HO4S- • 4H2O4S) + H2O = (HO4S- • H2O • 4H2O4S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 | kJ/mol | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 233. | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
By formula: HS- + H2O = (HS- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.4 ± 4.2 | kJ/mol | TDAs | Meot-ner, 1988, 2 | gas phase; B,M |
ΔrH° | 59.4 | kJ/mol | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.2 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
ΔrS° | 78.2 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 36. ± 8.4 | kJ/mol | TDAs | Meot-ner, 1988, 2 | gas phase; B |
By formula: (HS- • H2O) + H2O = (HS- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.7 | kJ/mol | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
ΔrH° | 52.7 | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 85.4 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
ΔrS° | 85.4 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
By formula: (HS- • 2H2O) + H2O = (HS- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 | kJ/mol | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
ΔrH° | 49.0 | kJ/mol | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.3 | J/mol*K | PHPMS | Sieck and Meot-ner, 1989 | gas phase; M |
ΔrS° | 98.3 | J/mol*K | PHPMS | Meot-ner, 1988, 2 | gas phase; M |
By formula: H2BrO4- + 2H2O = H4BrO5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H2IO4- + 2H2O = H4IO5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.2 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20.9 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H2N3O- + 2H2O = H4N3O2-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. ± 390. | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 3.78±0.06 eV; B |
By formula: H2O+ + H2O = (H2O+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 150. | kJ/mol | PI | Ng, Trevor, et al., 1977 | gas phase; ΔrH>; M |
By formula: H2O2- + 2H2O = H4O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 77.0 ± 7.5 | kJ/mol | LPES | Clements, Luong, et al., 2001 | gas phase; B |
By formula: H2O3- + C5H5N + H2O = C5H7NO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 137. ± 9.6 | kJ/mol | N/A | Le Barbu, Schiedt, et al., 2002 | gas phase; Affinity is difference in EAs of lesser solvated species; B |
By formula: H2O3- + C10H8 + H2O = C10H10O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 158. ± 9.6 | kJ/mol | N/A | Le Barbu, Schiedt, et al., 2002 | gas phase; Affinity is difference in EAs of lesser solvated species; B |
By formula: H2O3P- + H2O = (H2O3P- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 33. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (H2O3P- • H2O) + H2O = (H2O3P- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (H2O3P- • 2H2O) + H2O = (H2O3P- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: H2O4P- + H2O = (H2O4P- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.6 | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.9 | J/mol*K | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 32. | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
ΔrG° | 32. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (H2O4P- • H2O) + H2O = (H2O4P- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (H2O4P- • 2H2O) + H2O = (H2O4P- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 20. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: H2O7S4-2 + 2H2O = H4O8S4-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 32.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H3O+ + H2O = (H3O+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 136. ± 9. | kJ/mol | AVG | N/A | Average of 7 out of 14 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. ± 30. | J/mol*K | AVG | N/A | Average of 5 out of 7 values; Individual data points |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 300. | HPMS | Arifov, Pozharov, et al., 1971 | gas phase; M |
By formula: (H3O+ • H2O) + H2O = (H3O+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 84. ± 5. | kJ/mol | AVG | N/A | Average of 7 out of 14 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94. ± 20. | J/mol*K | AVG | N/A | Average of 5 out of 7 values; Individual data points |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
36. | 300. | HPMS | Arifov, Pozharov, et al., 1971 | gas phase; M |
By formula: (H3O+ • 2H2O) + H2O = (H3O+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 73. ± 4. | kJ/mol | AVG | N/A | Average of 9 out of 16 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 118. ± 8. | J/mol*K | AVG | N/A | Average of 6 out of 9 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 39. | kJ/mol | FA | Bierbaum, Golde, et al., 1976 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
38. | 300. | HPMS | Arifov, Pozharov, et al., 1971 | gas phase; M |
38. | 296. | SAMS | Puckett and Teague, 1971 | gas phase; M |
35. | 300. | PHPMS | Good, Durden, et al., 1970 | gas phase; M |
35. | 307. | PHPMS | Good, Durden, et al., 1970, 2 | gas phase; M |
By formula: (H3O+ • 3H2O) + H2O = (H3O+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56. ± 20. | kJ/mol | AVG | N/A | Average of 6 out of 9 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. ± 20. | J/mol*K | AVG | N/A | Average of 5 out of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 23. | kJ/mol | FA | Bierbaum, Golde, et al., 1976 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
24. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
23. | 296. | SAMS | Puckett and Teague, 1971 | gas phase; M |
21. | 300. | PHPMS | Good, Durden, et al., 1970 | gas phase; M |
21. | 307. | PHPMS | Good, Durden, et al., 1970, 2 | gas phase; M |
29. | 300. | HPMS | Arifov, Pozharov, et al., 1971 | gas phase; M |
By formula: (H3O+ • 4H2O) + H2O = (H3O+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50. ± 8. | kJ/mol | AVG | N/A | Average of 5 out of 8 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. ± 20. | J/mol*K | AVG | N/A | Average of 4 out of 6 values; Individual data points |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: (H3O+ • 5H2O) + H2O = (H3O+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.8 | kJ/mol | PHPMS | Lau, Ikuta, et al., 1982 | gas phase; M |
ΔrH° | 49.0 | kJ/mol | HPMS | Kebarle, Searles, et al., 1967 | gas phase; M |
ΔrH° | 67.32 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; Entropy change is questionable; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | PHPMS | Lau, Ikuta, et al., 1982 | gas phase; M |
ΔrS° | 124. | J/mol*K | HPMS | Kebarle, Searles, et al., 1967 | gas phase; M |
ΔrS° | 346.0 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; Entropy change is questionable; M |
By formula: (H3O+ • 6H2O) + H2O = (H3O+ • 7H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
ΔrH° | 43.1 | kJ/mol | HPMS | Kebarle, Searles, et al., 1967 | gas phase; M |
ΔrH° | 50.33 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; Entropy change is questionable; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | HPMS | Kebarle, Searles, et al., 1967 | gas phase; M |
ΔrS° | 218.9 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; Entropy change is questionable; M |
By formula: (H3O+ • 7H2O) + H2O = (H3O+ • 8H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40.9 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 21. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 140.0 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 8H2O) + H2O = (H3O+ • 9H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 36.7 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 24. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 112.6 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 9H2O) + H2O = (H3O+ • 10H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37.2 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 107.8 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 10H2O) + H2O = (H3O+ • 11H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38.9 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 112.6 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 11H2O) + H2O = (H3O+ • 12H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.1 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 29. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 140.7 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 12H2O) + H2O = (H3O+ • 13H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.10 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 158.7 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 13H2O) + H2O = (H3O+ • 14H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.35 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 166.7 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 14H2O) + H2O = (H3O+ • 15H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.85 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 168.9 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 15H2O) + H2O = (H3O+ • 16H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.27 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 25. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 176.4 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 16H2O) + H2O = (H3O+ • 17H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.02 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 173.1 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 17H2O) + H2O = (H3O+ • 18H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.98 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 26. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 170.0 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 18H2O) + H2O = (H3O+ • 19H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.60 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 29. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 171.5 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 19H2O) + H2O = (H3O+ • 20H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.10 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 38. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 165.8 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 20H2O) + H2O = (H3O+ • 21H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.64 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 31. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 156.7 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 21H2O) + H2O = (H3O+ • 22H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.18 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 25. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 165.1 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 22H2O) + H2O = (H3O+ • 23H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.72 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 27. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 162.8 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 23H2O) + H2O = (H3O+ • 24H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.01 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 28. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 156.7 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 24H2O) + H2O = (H3O+ • 25H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.09 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 30. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 151.3 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 25H2O) + H2O = (H3O+ • 26H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40.7 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 26. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 137.4 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 26H2O) + H2O = (H3O+ • 27H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39.4 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
ΔrH° | 34. | kJ/mol | CID | Magnera, David, et al., 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 129.4 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: (H3O+ • 27H2O) + H2O = (H3O+ • 28H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37.9 | kJ/mol | MKER | Shi, Ford, et al., 1993 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 116.2 | J/mol*K | MKER | Shi, Ford, et al., 1993 | gas phase; M |
By formula: H3S+ + H2O = (H3S+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 88.7 | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O; Cunningham, Payzant, et al., 1972, Yamdagni and Kebarle, 1976; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; From thermochemical cycle,switching reaction(H3O+)H2O; Cunningham, Payzant, et al., 1972, Yamdagni and Kebarle, 1976; M |
By formula: (H3S+ • H2O) + H2O = (H3S+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 84.9 | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; From thermochemical cycle,switching reaction(H3O+ H2O)H2O; Cunningham, Payzant, et al., 1972, Yamdagni and Kebarle, 1976; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.2 | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; From thermochemical cycle,switching reaction(H3O+ H2O)H2O; Cunningham, Payzant, et al., 1972, Yamdagni and Kebarle, 1976; M |
By formula: (H3S+ • 2H2O) + H2O = (H3S+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 18. | kJ/mol | PI | Walters and Blais, 1984 | gas phase; M |
By formula: (H3S+ • H2S) + H2O = (H3S+ • H2O • H2S)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 79.9 | kJ/mol | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; From thermochemical cycle,switching reaction(H3S+ H2O)H2O; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.2 | J/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; From thermochemical cycle,switching reaction(H3S+ H2O)H2O; Cunningham, Payzant, et al., 1972, Lias, Liebman, et al., 1984; M |
By formula: H4ClO2- + CH4O + 2H2O = CH8ClO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.51 ± 0.84 | kJ/mol | TDAs | Evans and Keesee, 1991 | gas phase; B |
ΔrH° | 47.7 ± 1.3 | kJ/mol | TDAs | Evans and Keesee, 1991 | gas phase; For solvation by MeOH of core ion; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 24.3 | kJ/mol | TDAs | Evans and Keesee, 1991 | gas phase; B |
ΔrG° | 25.1 | kJ/mol | TDAs | Evans and Keesee, 1991 | gas phase; For solvation by MeOH of core ion; B |
By formula: H4IO5- + 3H2O = H6IO6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 17.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H4N+ + H2O = (H4N+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 86.2 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; M |
ΔrH° | 83.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 72.4 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; M |
ΔrS° | 96.7 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 82.4 | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: (H4N+ • H2O) + H2O = (H4N+ • 2H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.8 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; ΔrH?, Entropy change is questionable, appear out of line; M |
ΔrH° | 57.3 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; ΔrH of 51.9 kJ/mol from plot is too small; M |
ΔrH° | 61.5 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; ΔrH?, Entropy change is questionable, appear out of line; M |
ΔrS° | 92.0 | J/mol*K | N/A | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; ΔrH of 51.9 kJ/mol from plot is too small; M |
ΔrS° | 91.6 | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 37. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 414. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; Entropy change calculated or estimated; ΔrH of 51.9 kJ/mol from plot is too small; M |
By formula: (H4N+ • 2H2O) + H2O = (H4N+ • 3H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.3 | kJ/mol | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; M |
ΔrH° | 56.1 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
ΔrH° | 51.0 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | PHPMS | Meot-Ner (Mautner) and Speller, 1986 | gas phase; M |
ΔrS° | 105. | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
ΔrS° | 88.7 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 27. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (H4N+ • 3H2O) + H2O = (H4N+ • 4H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.2 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 51.0 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.2 | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 114. | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (H4N+ • 4H2O) + H2O = (H4N+ • 5H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.4 | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrH° | 41. | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 113. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
ΔrS° | 93.7 | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: (H4N+ • 5H2O) + H2O = (H4N+ • 6H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13. | 266. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (H4N+ • 6H2O) + H2O = (H4N+ • 7H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 35. | kJ/mol | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12. | 254. | PHPMS | Meot-Ner (Mautner), 1984 | gas phase; M |
By formula: (H4N+ • H2O • H3N) + H2O = (H4N+ • 2H2O • H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.1 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: (H4N+ • H2O • 2H3N) + H2O = (H4N+ • 2H2O • 2H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 116. | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: (H4N+ • 2H2O • H3N) + H2O = (H4N+ • 3H2O • H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 119. | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: (H4N+ • H2O • O2S) + H2O = (H4N+ • 2H2O • O2S)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; From thermochemical cycle,switching reaction, electric fields; M |
By formula: (H4N+ • 2H2O • O2S) + H2O = (H4N+ • 3H2O • O2S)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22. | kJ/mol | HPMS | Banic and Iribarne, 1985 | gas phase; From thermochemical cycle,switching reaction, electric fields; M |
By formula: (H4N+ • H3N) + H2O = (H4N+ • H2O • H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.9 | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: (H4N+ • 2H3N) + H2O = (H4N+ • H2O • 2H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.9 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 103. | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: (H4N+ • 3H3N) + H2O = (H4N+ • H2O • 3H3N)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 | kJ/mol | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 117. | J/mol*K | PHPMS | Payzant, Cunningham, et al., 1973 | gas phase; M |
By formula: H4N3O2- + 3H2O = H6N3O3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.35 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 4.25±0.06 eV; B |
By formula: H4O3P- + 2H2O = H6O4P-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.1 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H4O4- + C10H8 + 2H2O = C10H12O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 219. ± 9.6 | kJ/mol | N/A | Le Barbu, Schiedt, et al., 2002 | gas phase; Affinity is difference in EAs of lesser solvated species; B |
By formula: H4O4P- + 2H2O = H6O5P-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 27.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H4O5P- + 2H2O = H6O6P-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 ± 4.2 | kJ/mol | TDAs | Blades, Ho, et al., 1996, 3 | gas phase; B |
ΔrH° | 54.8 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25.5 ± 2.1 | kJ/mol | TDAs | Blades, Ho, et al., 1996, 3 | gas phase; B |
ΔrG° | 25.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H4O8S4-2 + 3H2O = H6O9S4-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H4O10S2-2 + 3H2O = H6O11S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H4P+ + H2O = (H4P+ • H2O)
Bond type: Hydrogen bond (positive ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54. | kJ/mol | ICR | Berman and Beauchamp, 1986 | gas phase; bracketing; Meot-Ner, 1984, 2, Lias, Liebman, et al., 1984; M |
By formula: H6N3O3- + 4H2O = H8N3O4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 32.6 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 4.63±0.06 eV; B |
By formula: H6O4P- + 3H2O = H8O5P-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 19.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H6O5P- + 3H2O = H8O6P-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H6O6P- + 3H2O = H8O7P-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.5 ± 4.2 | kJ/mol | TDAs | Blades, Ho, et al., 1996 | gas phase; B |
ΔrH° | 49.4 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 4.2 | kJ/mol | TDAs | Blades, Ho, et al., 1996 | gas phase; B |
ΔrG° | 20.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
By formula: H6O9S2-2 + 4H2O = H8O10S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 33.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H6O9S4-2 + 4H2O = H8O10S4-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H6O11S2-2 + 4H2O = H8O12S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H8N3O4- + 5H2O = H10N3O5-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 15.5 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change from (H2O)n-1..N3- ion. Vertical Detachment Energy: 4.85±0.06 eV; B |
H8O10S2-2 + 5 = H10O11S2-2
By formula: H8O10S2-2 + 5H2O = H10O11S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 29.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H8O10S4-2 + 5 = H10O11S4-2
By formula: H8O10S4-2 + 5H2O = H10O11S4-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H8O12S2-2 + 5 = H10O13S2-2
By formula: H8O12S2-2 + 5H2O = H10O13S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H10N3O5- + 6H2O = H12N3O6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 15.5 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.03±0.08 eV; B |
By formula: H10O8S2-2 + 6H2O = H12O9S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 30.5 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H10O11S2-2 + 6 = H12O12S2-2
By formula: H10O11S2-2 + 6H2O = H12O12S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H10O13S2-2 + 6 = H12O14S2-2
By formula: H10O13S2-2 + 6H2O = H12O14S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H12N3O6- + 7H2O = H14N3O7-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 13.4 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.25±0.08 eV; B |
H12O9S2-2 + 7 = H14O10S2-2
By formula: H12O9S2-2 + 7H2O = H14O10S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 27.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H12O10S-2 + 7H2O = H14O11S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.2 ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 31. ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
ΔrG° | 31.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H12O10Se-2 + 7 = H14O11Se-2
By formula: H12O10Se-2 + 7H2O = H14O11Se-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 29.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H12O12P2-2 + 6 = H14O13P2-2
By formula: H12O12P2-2 + 6H2O = H14O13P2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 0.84 | kJ/mol | IMRE | Blades, Ho, et al., 1996 | gas phase; Correction to published article: P. Kebarle; B |
H12O12S2-2 + 7 = H14O13S2-2
By formula: H12O12S2-2 + 7H2O = H14O13S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H14N3O7- + 8H2O = H16N3O8-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 13.4 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.42±0.08 eV; B |
H14O10S2-2 + 8 = H16O11S2-2
By formula: H14O10S2-2 + 8H2O = H16O11S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H14O11S-2 + 8H2O = H16O12S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.9 ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 28. ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
ΔrG° | 28.0 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H14O11Se-2 + 8 = H16O12Se-2
By formula: H14O11Se-2 + 8H2O = H16O12Se-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 26.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H14O13S2-2 + 8 = H16O14S2-2
By formula: H14O13S2-2 + 8H2O = H16O14S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H16N3O8- + 9H2O = H18N3O9-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 13.4 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.55±0.08 eV; B |
H16O11S2-2 + 9 = H18O12S2-2
By formula: H16O11S2-2 + 9H2O = H18O12S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 22.2 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H16O12S-2 + 9H2O = H18O13S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
ΔrG° | 25.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
H16O12Se-2 + 9 = H18O13Se-2
By formula: H16O12Se-2 + 9H2O = H18O13Se-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.4 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H18N3O9- + 10H2O = H20N3O10-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.6 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change from (H2O))n-1..N3- ion. Vertical Detachment Energy: 5.65±0.08 eV; B |
H18O12S2-2 + 10 = H20O13S2-2
By formula: H18O12S2-2 + 10H2O = H20O13S2-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 19.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
By formula: H18O13S-2 + 10H2O = H20O14S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.6 ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 24. ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
By formula: H20N3O10- + 11H2O = H22N3O11-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.79 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.70±0.08 eV; B |
By formula: H20O14S-2 + 11H2O = H22O15S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.6 ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 22. ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
By formula: H22N3O11- + 12H2O = H24N3O12-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.9 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.79±0.08 eV; B |
By formula: H24N3O12- + 13H2O = H26N3O13-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.53 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.89±0.08 eV; B |
By formula: H26N3O13- + 14H2O = H28N3O14-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3.8 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 5.95±0.08 eV; B |
By formula: H28N3O14- + 15H2O = H30N3O15-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.79 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 6.02±0.08 eV; B |
By formula: H30N3O15- + 16H2O = H32N3O16-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3.8 | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 6.07±0.08 eV; B |
By formula: I- + H2O = (I- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43. ± 3. | kJ/mol | AVG | N/A | Average of 6 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 64.0 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 80.8 | J/mol*K | HPMS | Keesee and Castleman, 1980 | gas phase; M |
ΔrS° | 68.2 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 23. ± 1. | kJ/mol | AVG | N/A | Average of 6 values; Individual data points |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 300. | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (I- • H2O) + H2O = (I- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.4 ± 0.84 | kJ/mol | TDAs | Keesee and Castleman, 1980 | gas phase; B,M |
ΔrH° | 39.7 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 39.7 ± 0.84 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 41. ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrH° | 41. ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 73.6 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 84.9 | J/mol*K | HPMS | Keesee and Castleman, 1980 | gas phase; M |
ΔrS° | 79.5 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 17. ± 2. | kJ/mol | AVG | N/A | Average of 6 values; Individual data points |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
17. | 300. | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (I- • 2H2O) + H2O = (I- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38.9 ± 1.3 | kJ/mol | TDAs | Keesee and Castleman, 1980 | gas phase; B,M |
ΔrH° | 36. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
ΔrH° | 38.5 ± 0.84 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 39. ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrH° | 39. ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 85.4 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
ΔrS° | 87.9 | J/mol*K | HPMS | Keesee and Castleman, 1980 | gas phase; M |
ΔrS° | 89.1 | J/mol*K | HPMS | Arshadi, Yamdagni, et al., 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 12.6 | kJ/mol | TDAs | Keesee and Castleman, 1980 | gas phase; B |
ΔrG° | 13.0 ± 3.3 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 14. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (I- • 3H2O) + H2O = (I- • 4H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 38.5 ± 1.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B,M |
ΔrH° | 29. ± 9.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.7 | J/mol*K | PHPMS | Hiraoka, Mizuse, et al., 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 8.8 ± 6.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; B |
ΔrG° | 9.2 ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (I- • 4H2O) + H2O = (I- • 5H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37.7 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy estimated; B,M |
ΔrH° | 17.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 6.28 | kJ/mol | TDAs | Hiraoka, Mizuse, et al., 1988 | gas phase; Entropy estimated; B |
By formula: (I- • 5H2O) + H2O = (I- • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 32.6 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 6H2O) + H2O = (I- • 7H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.53 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 7H2O) + H2O = (I- • 8H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.9 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 8H2O) + H2O = (I- • 9H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 16.3 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 9H2O) + H2O = (I- • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.86 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 10H2O) + H2O = (I- • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.9 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 11H2O) + H2O = (I- • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.86 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 12H2O) + H2O = (I- • 13H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.53 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 13H2O) + H2O = (I- • 14H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 0.84 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 14H2O) + H2O = (I- • 15H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.02 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • 15H2O) + H2O = (I- • 16H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.02 | kJ/mol | N/A | Markovich, Pollack, et al., 1994 | gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B |
By formula: (I- • O2S) + H2O = (I- • H2O • O2S)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 14.6 ± 0.42 | kJ/mol | TDAs | Banic and Iribarne, 1985 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 300. | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
By formula: (K+ • CH4O) + H2O = (K+ • H2O • CH4O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.3 | kJ/mol | HPMS | Evans and Keesee, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.1 | J/mol*K | HPMS | Evans and Keesee, 1991 | gas phase; M |
By formula: (K+ • 2CH4O) + H2O = (K+ • H2O • 2CH4O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.3 | kJ/mol | HPMS | Evans and Keesee, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 75.3 | J/mol*K | HPMS | Evans and Keesee, 1991 | gas phase; M |
By formula: (K+ • C6H6) + H2O = (K+ • H2O • C6H6)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 75.7 | kJ/mol | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; switching reaction(K+ C6H6)C6H6; Searles and Kebarle, 1969; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 125. | J/mol*K | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; switching reaction(K+ C6H6)C6H6; Searles and Kebarle, 1969; M |
By formula: (K+ • 2C6H6) + H2O = (K+ • H2O • 2C6H6)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.3 | kJ/mol | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; switching reaction(K+ 2H2O)C6H6; Searles and Kebarle, 1969; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; switching reaction(K+ 2H2O)C6H6; Searles and Kebarle, 1969; M |
By formula: K+ + H2O = (K+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.7 | kJ/mol | HPMS | Davidson and Kebarle, 1976 | gas phase; M |
ΔrH° | 70. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrH° | 81. ± 10. | kJ/mol | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
ΔrH° | 74.9 | kJ/mol | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 83.3 | J/mol*K | HPMS | Davidson and Kebarle, 1976 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrS° | 89.1 | J/mol*K | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
ΔrS° | 90.4 | J/mol*K | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
38. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
2. | 840. | MS | Chupka, 1959 | gas phase; Knudsen cell, 840+-50K; M |
By formula: (K+ • H2O • CH4O) + H2O = (K+ • 2H2O • CH4O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.8 | kJ/mol | HPMS | Evans and Keesee, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.6 | J/mol*K | HPMS | Evans and Keesee, 1991 | gas phase; M |
By formula: (K+ • H2O • C6H6) + H2O = (K+ • 2H2O • C6H6)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.1 | kJ/mol | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; From thermochemical cycle,switching reaction(K+)3H2O; Searles and Kebarle, 1969; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.5 | J/mol*K | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; From thermochemical cycle,switching reaction(K+)3H2O; Searles and Kebarle, 1969; M |
By formula: (K+ • H2O • 2C6H6) + H2O = (K+ • 2H2O • 2C6H6)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 | kJ/mol | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; From thermochemical cycle(K+ 3H2O)C6H6; Searles and Kebarle, 1969; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 123. | J/mol*K | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; From thermochemical cycle(K+ 3H2O)C6H6; Searles and Kebarle, 1969; M |
By formula: (K+ • 2H2O • C6H6) + H2O = (K+ • 3H2O • C6H6)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 49.4 | kJ/mol | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; From thermochemical cycle,switching reaction(K+)4H2O; Searles and Kebarle, 1969; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | HPMS | Sunner, Nishizawa, et al., 1981 | gas phase; From thermochemical cycle,switching reaction(K+)4H2O; Searles and Kebarle, 1969; M |
By formula: (K+ • H2O) + H2O = (K+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrH° | 67.4 | kJ/mol | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrS° | 101. | J/mol*K | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
38. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (K+ • 2H2O) + H2O = (K+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrH° | 55.2 | kJ/mol | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.1 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrS° | 96.2 | J/mol*K | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (K+ • 3H2O) + H2O = (K+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrH° | 49.4 | kJ/mol | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrS° | 103. | J/mol*K | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (K+ • 4H2O) + H2O = (K+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.8 | kJ/mol | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | HPMS | Searles and Kebarle, 1969 | gas phase; M |
By formula: (K+ • 5H2O) + H2O = (K+ • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | HPMS | Searles and Kebarle, 1969 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | HPMS | Searles and Kebarle, 1969 | gas phase; M |
By formula: Li+ + H2O = (Li+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 135. ± 7.9 | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 140. | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; interpolated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; interpolated; M |
By formula: (Li+ • H2O) + H2O = (Li+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 113. ± 10. | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 108. | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.3 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
By formula: (Li+ • 2H2O) + H2O = (Li+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 94.1 ± 4.2 | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 70. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray; M |
ΔrH° | 86.6 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray; M |
ΔrS° | 104. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
41.8 | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray; M |
By formula: (Li+ • 3H2O) + H2O = (Li+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 69.9 ± 5.0 | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 68.6 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 125. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Li+ • 4H2O) + H2O = (Li+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 ± 4.2 | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 58.2 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrH° | 50. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 131. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Li+ • 5H2O) + H2O = (Li+ • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 59.8 ± 5.0 | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 50.6 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 134. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
By formula: Mg+ + H2O = (Mg+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 118. ± 13. | kJ/mol | CIDT | Andersen, Muntean, et al., 2000 | RCD |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
119. (+13.,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Mg+ (3s1); M |
By formula: (Mg+ • H2O) + H2O = (Mg+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 93.3 ± 6.7 | kJ/mol | CIDT | Andersen, Muntean, et al., 2000 | RCD |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
93.7 (+6.7,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Mg+ (3s1); M |
By formula: (Mg+ • 2H2O) + H2O = (Mg+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.4 ± 8.8 | kJ/mol | CIDT | Andersen, Muntean, et al., 2000 | RCD |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
72.4 (+8.8,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Mg+ (3s1); M |
By formula: (Mg+ • 3H2O) + H2O = (Mg+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.1 ± 8.8 | kJ/mol | CIDT | Andersen, Muntean, et al., 2000 | RCD |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
48.1 (+8.8,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Mg+ (3s1); M |
By formula: (Mg+2 • 7H2O) + H2O = (Mg+2 • 8H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
35. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mg+2 • 8H2O) + H2O = (Mg+2 • 9H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mg+2 • 9H2O) + H2O = (Mg+2 • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mg+2 • 10H2O) + H2O = (Mg+2 • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
31. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mg+2 • 11H2O) + H2O = (Mg+2 • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
30. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mg+2 • 12H2O) + H2O = (Mg+2 • 13H2O)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (Mg+2 • 13H2O) + H2O = (Mg+2 • 14H2O)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (Mg+2 • 14H2O) + H2O = (Mg+2 • 15H2O)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (Mg+2 • 15H2O) + H2O = (Mg+2 • 16H2O)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 293. | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: Mn+ + H2O = (Mn+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 140. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
ΔrH° | 111. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
119. (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • H2O) + H2O = (Mn+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.5 | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
90.0 (+5.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • 2H2O) + H2O = (Mn+ • 3H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
108. (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • 3H2O) + H2O = (Mn+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
50.2 (+5.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+2 • 8H2O) + H2O = (Mn+2 • 9H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
35. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mn+2 • 9H2O) + H2O = (Mn+2 • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mn+2 • 10H2O) + H2O = (Mn+2 • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
32. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Mn+2 • 11H2O) + H2O = (Mn+2 • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: NO- + H2O = (NO- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 77.4 | kJ/mol | PHPMS | French, Hills, et al., 1973 | gas phase; M |
ΔrH° | 69.5 | kJ/mol | PES | Eaton, Arnold, et al., 1990 | gas phase; M |
ΔrH° | 95.0 | kJ/mol | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.2 | J/mol*K | PHPMS | French, Hills, et al., 1973 | gas phase; M |
ΔrS° | 100. | J/mol*K | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
53.1 | 296. | SAMS | Puckett and Teague, 1971 | gas phase; switching reaction(NO+)NO; M |
By formula: (NO- • H2O) + H2O = (NO- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65.69 | kJ/mol | N/A | Eaton, Arnold, et al., 1990 | gas phase; Vertical Detachment Energy: 1.860±0.020 eV; B,M |
ΔrH° | 67.4 | kJ/mol | PHPMS | French, Hills, et al., 1973 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 107. | J/mol*K | PHPMS | French, Hills, et al., 1973 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
35. | 293. | HPMS | McAdams and Bone, 1972 | gas phase; M |
36. | 296. | FA | Howard, Rundle, et al., 1971 | gas phase; M |
36. | 296. | SAMS | Puckett and Teague, 1971 | gas phase; M |
By formula: (NO- • 2H2O) + H2O = (NO- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 74.5 | kJ/mol | PES | Eaton, Arnold, et al., 1990 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23. | 308. | PHPMS | French, Hills, et al., 1973 | gas phase; M |
25. | 293. | HPMS | McAdams and Bone, 1972 | gas phase; M |
25. | 296. | FA | Howard, Rundle, et al., 1971 | gas phase; M |
25. | 296. | SAMS | Puckett and Teague, 1971 | gas phase; M |
By formula: NO2+ + H2O = (NO2+ • H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
67.4 (+9.6,-0.) | PD/KERD | Graul, Kim, et al., 1992 | gas phase; M |
By formula: NO2- + H2O = (NO2- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 65. ± 20. | kJ/mol | AVG | N/A | Average of 6 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.9 | J/mol*K | PHPMS | Sieck, 1985 | gas phase; M |
ΔrS° | 83.7 | J/mol*K | FA | Bohringer, Fahey, et al., 1984 | gas phase; switching reaction(NO2-)H2O; Lee, Keesee, et al., 1980; M |
ΔrS° | 99.6 | J/mol*K | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
ΔrS° | 88. | J/mol*K | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 35.6 ± 0.84 | kJ/mol | TDAs | Sieck, 1985 | gas phase; B |
ΔrG° | 35.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 34. ± 24. | kJ/mol | Endo | Paulson and Dale, 1982 | gas phase; B |
ΔrG° | 33.9 ± 0.84 | kJ/mol | TDAs | Lee, Keesee, et al., 1980 | gas phase; B |
ΔrG° | 33.5 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
35. | 300. | SAMS | Payzant, Cunningham, et al., 1972 | gas phase; M |
By formula: (NO2- • H2O) + H2O = (NO2- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 54.0 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B,M |
ΔrH° | 54.0 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrH° | 56.9 | kJ/mol | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
ΔrS° | 99.2 | J/mol*K | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 25.1 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 24. ± 5.9 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrG° | 24.3 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 26. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
24. | 300. | SAMS | Payzant, Cunningham, et al., 1972 | gas phase; M |
By formula: (NO2- • 2H2O) + H2O = (NO2- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.1 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 43.5 ± 4.2 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B,M |
ΔrH° | 43.5 ± 4.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrH° | 49.0 | kJ/mol | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
ΔrS° | 88.7 | J/mol*K | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 17. ± 5.9 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
ΔrG° | 17.2 | kJ/mol | TDAs | Arshadi, Yamdagni, et al., 1970 | gas phase; B |
ΔrG° | 19. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
By formula: (NO2- • 3H2O) + H2O = (NO2- • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.5 | kJ/mol | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 121. | J/mol*K | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
By formula: (NO3- • HNO3) + H2O = (NO3- • H2O • HNO3)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.4 | kJ/mol | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | N/A | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31. | 233. | ATM | Arnold, Viggiano, et al., 1982 | gas phase; Entropy change calculated or estimated; M |
By formula: NO3- + H2O = (NO3- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 61.09 ± 0.84 | kJ/mol | N/A | Lee, Keesee, et al., 1980 | gas phase; B,M |
ΔrH° | 59.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 51.88 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B,M |
ΔrH° | 61.9 | kJ/mol | ATM | Arnold and Qiu, 1984 | gas phase; Entropy change calculated or estimated; M |
ΔrH° | 80.3 | kJ/mol | FA | Bohringer, Fahey, et al., 1984 | gas phase; switching reaction(NO3-)H2O; Lee, Keesee, et al., 1980; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
ΔrS° | 100. | J/mol*K | N/A | Arnold and Qiu, 1984 | gas phase; Entropy change calculated or estimated; M |
ΔrS° | 89.1 | J/mol*K | FA | Bohringer, Fahey, et al., 1984 | gas phase; switching reaction(NO3-)H2O; Lee, Keesee, et al., 1980; M |
ΔrS° | 79.9 | J/mol*K | HPMS | Payzant, Yamdagni, et al., 1971 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 30.1 ± 1.3 | kJ/mol | TDAs | Lee, Keesee, et al., 1980 | gas phase; B |
ΔrG° | 29.7 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 30.5 ± 0.42 | kJ/mol | TDAs | Banic and Iribarne, 1985 | gas phase; B |
ΔrG° | 28.0 | kJ/mol | TDAs | Payzant, Yamdagni, et al., 1971 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
37. | 250. | ATM | Arnold and Qiu, 1984 | gas phase; Entropy change calculated or estimated; M |
28. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
29. | 300. | SAMS | Payzant, Cunningham, et al., 1972 | gas phase; M |
+
+
= C3H8NO6-
By formula: NO3- + H2O + C3H6O2 = C3H8NO6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 16.3 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
+
+
= C4H10NO6-
By formula: NO3- + H2O + C4H8O2 = C4H10NO6-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 15.9 ± 0.84 | kJ/mol | IMRE | Viidanoja, Reiner, et al., 2000 | gas phase; B |
By formula: (NO3- • H2O) + H2O = (NO3- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 59.8 | kJ/mol | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 127. | J/mol*K | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21.8 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
ΔrG° | 21.8 ± 0.42 | kJ/mol | TDAs | Banic and Iribarne, 1985 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 301. | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
21. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: (NO3- • 2H2O) + H2O = (NO3- • 3H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 45.6 ± 6.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B |
ΔrH° | 57.7 | kJ/mol | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 139. | J/mol*K | HPMS | Lee, Keesee, et al., 1980 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 16.3 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; T: 293 K. ΔSaff approx. 24 cal/mol-K; B,M |
By formula: (NO3- • O2S) + H2O = (NO3- • H2O • O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18.0 ± 0.42 | kJ/mol | TDAs | Banic and Iribarne, 1985 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18. | 299. | HPMS | Banic and Iribarne, 1985 | gas phase; electric fields; M |
+
= H2N3O-
By formula: N3- + H2O = H2N3O-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46. ± 75. | kJ/mol | N/A | Yang, Kiran, et al., 2004 | gas phase; Affinity: EA change (H2O)n-1..N3- ion. Vertical Detachment Energy: 3.25±0.03 eV; B |
By formula: (Na+ • CO2) + H2O = (Na+ • H2O • CO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 86.6 | kJ/mol | HPMS | Peterson, Mark, et al., 1984 | gas phase; From thermochemical cycle; Dzidic and Kebarle, 1970; M |
ΔrH° | 95.8 | kJ/mol | FA | Perry, Rowe, et al., 1980 | gas phase; From thermochemical cycle(Na+) 2H2O; Dzidic and Kebarle, 1970, Peterson, Mark, et al., 1984; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 106. | J/mol*K | HPMS | Peterson, Mark, et al., 1984 | gas phase; From thermochemical cycle; Dzidic and Kebarle, 1970; M |
ΔrS° | 107. | J/mol*K | FA | Perry, Rowe, et al., 1980 | gas phase; From thermochemical cycle(Na+) 2H2O; Dzidic and Kebarle, 1970, Peterson, Mark, et al., 1984; M |
By formula: Na+ + H2O = (Na+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 100. | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrH° | 87.9 ± 5.9 | kJ/mol | CIDC | Amicangelo and Armentrout, 2001 | Anchor NH3=24.41; RCD |
ΔrH° | 82.0 ± 5.9 | kJ/mol | CIDC | Amicangelo and Armentrout, 2001 | Anchor NH3=24.41; RCD |
ΔrH° | 95.0 ± 7.9 | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 111. | kJ/mol | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, 1600 K; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.0 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 92. | J/mol*K | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, 1600 K; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
94.6 (+7.5,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Na+ (3s0); M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
65.7 | 298. | IMRE | McMahon and Ohanessian, 2000 | Anchor alanine=39.89; RCD |
By formula: (Na+ • H2O • CO2) + H2O = (Na+ • 2H2O • CO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.8 | kJ/mol | HPMS | Peterson, Mark, et al., 1984 | gas phase; From thermochemical cycle; Dzidic and Kebarle, 1970; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.7 | J/mol*K | HPMS | Peterson, Mark, et al., 1984 | gas phase; From thermochemical cycle; Dzidic and Kebarle, 1970; M |
By formula: (Na+ • 2H2O • CO2) + H2O = (Na+ • 3H2O • CO2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.9 | kJ/mol | HPMS | Peterson, Mark, et al., 1984 | gas phase; From thermochemical cycle; Dzidic and Kebarle, 1970; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | HPMS | Peterson, Mark, et al., 1984 | gas phase; From thermochemical cycle; Dzidic and Kebarle, 1970; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 23. | kJ/mol | HPMS | Peterson, Mark, et al., 1984 | gas phase; From thermochemical cycle; Dzidic and Kebarle, 1970; M |
By formula: (Na+ • H2O) + H2O = (Na+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 79. ± 8. | kJ/mol | AVG | N/A | Average of 8 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92.9 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
82.0 (+5.9,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Na+ (3s0); M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
41.8 | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Na+ • 2H2O) + H2O = (Na+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 62.3 | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
ΔrH° | 66.1 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrH° | 69.9 ± 5.9 | kJ/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 67.4 | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
ΔrH° | 70. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
ΔrS° | 91.6 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 92.0 | J/mol*K | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 40. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
70.3 (+5.9,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Na+ (3s0); M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
39. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Na+ • 3H2O) + H2O = (Na+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 55. ± 4. | kJ/mol | AVG | N/A | Average of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 99. ± 10. | J/mol*K | AVG | N/A | Average of 6 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1996 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
54.8 (+5.9,-0.) | CID | Dalleska, Tjelta, et al., 1994 | gas phase; guided ion beam CID, Na+ (3s0); M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
27. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Na+ • 4H2O) + H2O = (Na+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.8 | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
ΔrH° | 48.5 | kJ/mol | HPMS | Tang and Castleman, 1972 | gas phase; M |
ΔrH° | 51.5 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
ΔrS° | 111. | J/mol*K | HPMS | Tang and Castleman, 1972 | gas phase; M |
ΔrS° | 118. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
20. | 293. | ES/HPMS | Klassen, Blades, et al., 1995 | gas phase; M |
By formula: (Na+ • 5H2O) + H2O = (Na+ • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.8 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 109. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
By formula: (Na+ • O2S) + H2O = (Na+ • H2O • O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 82.8 | kJ/mol | HPMS | Upschulte, Schelling, et al., 1984 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | HPMS | Upschulte, Schelling, et al., 1984 | gas phase; M |
By formula: Ni+ + H2O = (Ni+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 150. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
ΔrH° | 166. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
180. (+3.,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ni+ • H2O) + H2O = (Ni+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 170. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
168. (+7.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ni+ • 2H2O) + H2O = (Ni+ • 3H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
68.2 (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ni+ • 3H2O) + H2O = (Ni+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
51.9 (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ni+2 • 7H2O) + H2O = (Ni+2 • 8H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 300. | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ni+2 • 8H2O) + H2O = (Ni+2 • 9H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34. | 300. | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ni+2 • 9H2O) + H2O = (Ni+2 • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 300. | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ni+2 • 10H2O) + H2O = (Ni+2 • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31. | 300. | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ni+2 • 11H2O) + H2O = (Ni+2 • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31. | 300. | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Ni+2 • 12H2O) + H2O = (Ni+2 • 13H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31. | 300. | HPMS | Blades, Jayaweera, et al., 1990, 2 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: O- + H2O = (O- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 111. ± 7.5 | kJ/mol | PDis | Deyerl, Clements, et al., 2001 | gas phase; B |
ΔrH° | 2.2 | kJ/mol | N/A | Arnold, Xu, et al., 1995 | gas phase; Vertical Detachment Energy: 1.45 eV. Affinity is difference between EA of O-. and HOH..O-.; B |
ΔrH° | 126. | kJ/mol | PDiss | Roehl, Snodgrass, et al., 1991 | gas phase; ΔrH<; M |
ΔrH° | 130. | kJ/mol | FA | Fehsenfeld and Ferguson, 1974 | gas phase; bracketing, ΔrH<; M |
By formula: O2+ + H2O = (O2+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 67. | kJ/mol | FA | Adams and Bohme, 1970 | gas phase; switching reaction(O2+)SO2, ΔrH>; M |
By formula: O2- + H2O = (O2- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 93.3 ± 6.3 | kJ/mol | N/A | Luong, Clements, et al., 2001 | gas phase; Vertical Detachment Energy: 2.03±0.05 eV.; B |
ΔrH° | 77.0 ± 8.4 | kJ/mol | TDAs | Arshadi and Kebarle, 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.1 | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 52.3 ± 8.4 | kJ/mol | TDAs | Arshadi and Kebarle, 1970 | gas phase; B |
ΔrG° | 49.0 ± 8.4 | kJ/mol | IMRE | Parkes, 1971 | gas phase; B |
By formula: (O2- • H2O) + H2O = (O2- • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.0 ± 4.2 | kJ/mol | TDAs | Arshadi and Kebarle, 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 105. | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 40.6 | kJ/mol | TDAs | Arshadi and Kebarle, 1970 | gas phase; B |
ΔrG° | 36. ± 4.2 | kJ/mol | IMRE | Payzant J.D. and Kebarle, 1972 | gas phase; B |
ΔrG° | 41. ± 4.2 | kJ/mol | IMRE | Pack and Phelps, 1971 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
35. | 300. | PHPMS | Payzant J.D. and Kebarle, 1972 | gas phase; M |
By formula: (O2- • 2H2O) + H2O = (O2- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 64.4 ± 4.2 | kJ/mol | TDAs | Arshadi and Kebarle, 1970 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 118. | J/mol*K | PHPMS | Arshadi and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 29.3 | kJ/mol | TDAs | Arshadi and Kebarle, 1970 | gas phase; B |
ΔrG° | 26. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
30. | 300. | PHPMS | Payzant J.D. and Kebarle, 1972 | gas phase; M |
By formula: (O2- • 3H2O) + H2O = (O2- • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B,M |
ΔrG° | 14. | kJ/mol | PHPMS | Arshadi and Kebarle, 1970 | gas phase; M |
By formula: (O2- • 4H2O) + H2O = (O2- • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 14. ± 8.4 | kJ/mol | TDAs | Kebarle, Arshadi, et al., 1968 | gas phase; B |
(O2S- • • 3
) +
= (O2S- • 2
• 3
)
By formula: (O2S- • H2O • 3O2S) + H2O = (O2S- • 2H2O • 3O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 29.7 ± 1.7 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 15.9 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
(O2S- • • 4
) +
= (O2S- • 2
• 4
)
By formula: (O2S- • H2O • 4O2S) + H2O = (O2S- • 2H2O • 4O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 29.7 ± 2.9 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 12.6 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
(O2S- • 2 • 3
) +
= (O2S- • 3
• 3
)
By formula: (O2S- • 2H2O • 3O2S) + H2O = (O2S- • 3H2O • 3O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 27.6 ± 1.3 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 12.6 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
(O2S- • 2 • 4
) +
= (O2S- • 3
• 4
)
By formula: (O2S- • 2H2O • 4O2S) + H2O = (O2S- • 3H2O • 4O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 29.7 ± 2.9 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 10.9 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
By formula: (O2S- • O2S) + H2O = (O2S- • H2O • O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 37.2 ± 3.3 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18.0 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
By formula: (O2S- • 2O2S) + H2O = (O2S- • H2O • 2O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 31.0 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 15.1 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
By formula: (O2S- • 3O2S) + H2O = (O2S- • H2O • 3O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 31.8 ± 1.3 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 14.2 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
By formula: (O2S- • 4O2S) + H2O = (O2S- • H2O • 4O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 31.4 ± 1.7 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 13.8 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
By formula: (O2S- • 5O2S) + H2O = (O2S- • H2O • 5O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 27.2 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 13.0 ± 0.84 | kJ/mol | TDAs | Vacher, Leduc, et al., 1994 | gas phase; B |
By formula: (O3- • H2O) + H2O = (O3- • 2H2O)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
26. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: (O3- • 2H2O) + H2O = (O3- • 3H2O)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: O3P- + H2O = (O3P- • H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 54.0 ± 1.3 | kJ/mol | TDAs | Keesee and Castleman Jr., 1989 | gas phase; Not (HO)2PO2-. See also Blades, Ho, et al., 1996, 3 : (HO)2PO2- -> PO3- + HOH, Eact ca. 55 kcal/mol.; B,M,M |
ΔrH° | 52.7 | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 87.0 | J/mol*K | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
ΔrS° | 92.9 | J/mol*K | HPMS | Keesee and Castleman Jr., 1989 | gas phase; M |
ΔrS° | 87.0 | J/mol*K | HPMS | Keesee and Castleman Jr., 1989 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 5.0 | kJ/mol | TDAs | Keesee and Castleman Jr., 1989 | gas phase; Not (HO)2PO2-. See also Blades, Ho, et al., 1996, 3 : (HO)2PO2- -> PO3- + HOH, Eact ca. 55 kcal/mol.; B |
ΔrG° | 27. | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
By formula: (O3P- • H2O) + H2O = (O3P- • 2H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47.7 | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
ΔrH° | 47.7 | kJ/mol | HPMS | Keesee and Castleman Jr., 1989 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92.0 | J/mol*K | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
ΔrS° | 92.0 | J/mol*K | HPMS | Keesee and Castleman Jr., 1989 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 21. | kJ/mol | ES/HPMS | Blades, Ho, et al., 1996, 2 | gas phase; M |
By formula: (O3P- • 2H2O) + H2O = (O3P- • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.2 | kJ/mol | HPMS | Keesee and Castleman Jr., 1989 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 152. | J/mol*K | HPMS | Keesee and Castleman Jr., 1989 | gas phase; deuterated; M |
By formula: (O3P- • 3H2O) + H2O = (O3P- • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 | kJ/mol | HPMS | Keesee and Castleman Jr., 1989 | gas phase; deuterated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.1 | J/mol*K | HPMS | Keesee and Castleman Jr., 1989 | gas phase; deuterated; M |
By formula: O3S- + H2O = (O3S- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23.4 ± 0.84 | kJ/mol | IMRE | Möhler, Reiner, et al., 1992 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: O4S- + H2O = (O4S- • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 24.7 ± 0.84 | kJ/mol | IMRE | Möhler, Reiner, et al., 1992 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21. | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
By formula: (O4S- • H2O) + H2O = (O4S- • 2H2O)
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
6.7 | 296. | FA | Fehsenfeld and Ferguson, 1974 | gas phase; M |
+ 6
= H12O10S-2
By formula: O4S-2 + 6H2O = H12O10S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 35.6 ± 1.3 | kJ/mol | TDAs | Blades, Klassen, et al., 1995 | gas phase; B |
+ 12
= H24O16S-2
By formula: O4S-2 + 12H2O = H24O16S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.8 ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 20. ± 8.4 | kJ/mol | TDAs | Blades and Kebarle, 2005 | gas phase; B |
+ 13
= H26O17S-2
By formula: O4S-2 + 13H2O = H26O17S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21. ± 8.4 | kJ/mol | IMRE | Blades and Kebarle, 2005 | gas phase; dGaff at 270K; 298 value probably ca. 0.5 kcal/mole weaker; B |
+ 14
= H28O18S-2
By formula: O4S-2 + 14H2O = H28O18S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21. ± 8.4 | kJ/mol | IMRE | Blades and Kebarle, 2005 | gas phase; dGaff at 270K; 298 value probably ca. 0.5 kcal/mole weaker; B |
+ 15
= H30O19S-2
By formula: O4S-2 + 15H2O = H30O19S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 19. ± 8.4 | kJ/mol | IMRE | Blades and Kebarle, 2005 | gas phase; dGaff at 270K; 298 value probably ca. 0.5 kcal/mole weaker; B |
+ 16
= H32O20S-2
By formula: O4S-2 + 16H2O = H32O20S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18. ± 8.4 | kJ/mol | IMRE | Blades and Kebarle, 2005 | gas phase; dGaff at 270K; 298 value probably ca. 0.5 kcal/mole weaker; B |
+ 17
= H34O21S-2
By formula: O4S-2 + 17H2O = H34O21S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 18. ± 8.4 | kJ/mol | IMRE | Blades and Kebarle, 2005 | gas phase; dGaff at 270K; 298 value probably ca. 0.5 kcal/mole weaker; B |
+ 18
= H36O22S-2
By formula: O4S-2 + 18H2O = H36O22S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 16. ± 8.4 | kJ/mol | IMRE | Blades and Kebarle, 2005 | gas phase; dGaff at 270K; 298 value probably ca. 0.5 kcal/mole weaker; B |
+ 19
= H38O23S-2
By formula: O4S-2 + 19H2O = H38O23S-2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 15. ± 8.4 | kJ/mol | IMRE | Blades and Kebarle, 2005 | gas phase; dGaff at 270K; 298 value probably ca. 0.5 kcal/mole weaker; B |
By formula: (O4S-2 • 5H2O) + H2O = (O4S-2 • 6H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 36. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (O4S-2 • 6H2O) + H2O = (O4S-2 • 7H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 31. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (O4S-2 • 7H2O) + H2O = (O4S-2 • 8H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 28. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (O4S-2 • 8H2O) + H2O = (O4S-2 • 9H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 25. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (O4S-2 • 9H2O) + H2O = (O4S-2 • 10H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 23. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: (O4S-2 • 10H2O) + H2O = (O4S-2 • 11H2O)
Bond type: Hydrogen bond (negative ion to hydride)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrG° | 21. | kJ/mol | ES/HPMS | Blades, Klassen, et al., 1995 | gas phase; M |
By formula: Pb+ + H2O = (Pb+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 93.7 | kJ/mol | HPMS | Tang and Castleman, 1972 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 149. | J/mol*K | HPMS | Tang and Castleman, 1972 | gas phase; M |
By formula: (Pb+ • H2O) + H2O = (Pb+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 70.7 | kJ/mol | HPMS | Tang and Castleman, 1972 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 106. | J/mol*K | HPMS | Tang and Castleman, 1972 | gas phase; M |
By formula: (Pb+ • 2H2O) + H2O = (Pb+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 | kJ/mol | HPMS | Tang and Castleman, 1972 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 84.5 | J/mol*K | HPMS | Tang and Castleman, 1972 | gas phase; M |
By formula: (Pb+ • 4H2O) + H2O = (Pb+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.8 | kJ/mol | HPMS | Tang and Castleman, 1972 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 93.3 | J/mol*K | HPMS | Tang and Castleman, 1972 | gas phase; M |
By formula: (Pb+ • 5H2O) + H2O = (Pb+ • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40. | kJ/mol | HPMS | Tang and Castleman, 1972 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 98.7 | J/mol*K | HPMS | Tang and Castleman, 1972 | gas phase; M |
By formula: Rb+ + H2O = (Rb+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 66.5 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrH° | 70. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrH° | 66.9 | kJ/mol | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.7 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
ΔrS° | 84.1 | J/mol*K | MS | Burdett and Hayhurst, 1982 | gas phase; flame source, about 1600 K; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
39. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Rb+ • H2O) + H2O = (Rb+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92.9 | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Rb+ • 2H2O) + H2O = (Rb+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrH° | 50. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 100. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
25. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electrospray, Entropy change calculated or estimated; M |
By formula: (Rb+ • 3H2O) + H2O = (Rb+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.9 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 104. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
By formula: (Rb+ • 4H2O) + H2O = (Rb+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 43.9 | kJ/mol | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 108. | J/mol*K | HPMS | Dzidic and Kebarle, 1970 | gas phase; M |
By formula: Sc+ + H2O = (Sc+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 130. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
By formula: Sr+ + H2O = (Sr+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 144. | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 130. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+ • H2O) + H2O = (Sr+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 128. | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 118. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+ • 2H2O) + H2O = (Sr+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 108. | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 120. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+ • 3H2O) + H2O = (Sr+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 93.3 | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 118. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+ • 4H2O) + H2O = (Sr+ • 5H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 86.2 | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 128. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+ • 5H2O) + H2O = (Sr+ • 6H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 76.6 | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 128. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+ • 6H2O) + H2O = (Sr+ • 7H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 72.4 | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 144. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+ • 7H2O) + H2O = (Sr+ • 8H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 68.6 | kJ/mol | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 157. | J/mol*K | HPMS | Tang, Lian, et al., 1976 | gas phase; M |
By formula: (Sr+2 • 8H2O) + H2O = (Sr+2 • 9H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
33. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Sr+2 • 9H2O) + H2O = (Sr+2 • 10H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Sr+2 • 10H2O) + H2O = (Sr+2 • 11H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
30. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: (Sr+2 • 11H2O) + H2O = (Sr+2 • 12H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60. ± 10. | kJ/mol | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96. | J/mol*K | N/A | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
29. | 300. | HPMS | Blades, Jayaweera, et al., 1990 | gas phase; electospray, Entropy change calculated or estimated; M |
By formula: Ti+ + H2O = (Ti+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 160. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
154. (+5.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ti+ • H2O) + H2O = (Ti+ • 2H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
136. (+5.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ti+ • 2H2O) + H2O = (Ti+ • 3H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
66.9 (+7.1,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ti+ • 3H2O) + H2O = (Ti+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
83.7 (+7.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: V+ + H2O = (V+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 150. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
ΔrH° | 147. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
147. (+35.,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • H2O) + H2O = (V+ • 2H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 149. | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
151. (+10.,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • 2H2O) + H2O = (V+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 51.0 | kJ/mol | CID | Marinelli and Squires, 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
68.2 (+5.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • 3H2O) + H2O = (V+ • 4H2O)
Enthalpy of reaction
ΔrH° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
67.8 (+7.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: Zn+ + H2O = (Zn+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 160. ± 10. | kJ/mol | CID | Magnera, David, et al., 1989 | gas phase; M |
IR Spectrum
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, Ion clustering data, Vibrational and/or electronic energy levels, Gas Chromatography, References, Notes
Data compiled by: Coblentz Society, Inc.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Vibrational and/or electronic energy levels
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Takehiko Shimanouchi
Symmetry: C2ν Symmetry Number σ = 2
Sym. | No | Approximate | Selected Freq. | Infrared | Raman | Comments | ||||
---|---|---|---|---|---|---|---|---|---|---|
Species | type of mode | Value | Rating | Value | Phase | Value | Phase | |||
a1 | 1 | Sym str | 3657 | A | 3656.65 | gas | 3654 | gas | ||
a1 | 2 | Bend | 1595 | A | 1594.59 | gas | ||||
b1 | 3 | Anti str | 3756 | A | 3755.79 | gas | ||||
Source: Shimanouchi, 1972
Notes
A | 0~1 cm-1 uncertainty |
Gas Chromatography
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Vibrational and/or electronic energy levels, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, non-polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Packed | Apiezon L | 130. | 317. | Landault and Guiochon, 1964 | Teflon-Haloport; Column length: 2.26 m |
Normal alkane RI, non-polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | OV-101 | 319. | Zenkevich, 2005 | 25. m/0.20 mm/0.10 μm, N2/He, 6. K/min; Tstart: 50. C; Tend: 250. C |
Normal alkane RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Methyl Silicone | 327. | Zenkevich, Korolenko, et al., 1995 | Program: not specified |
Normal alkane RI, polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Polyethylene Glycol | 1039. | Zenkevich, Korolenko, et al., 1995 | Program: not specified |
Capillary | DB-Wax | 1066. | Peng, Yang, et al., 1991 | Program: not specified |
References
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Vibrational and/or electronic energy levels, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Cox, Wagman, et al., 1984
Cox, J.D.; Wagman, D.D.; Medvedev, V.A.,
CODATA Key Values for Thermodynamics, Hemisphere Publishing Corp., New York, 1984, 1. [all data]
Chase, 1998
Chase, M.W., Jr.,
NIST-JANAF Themochemical Tables, Fourth Edition,
J. Phys. Chem. Ref. Data, Monograph 9, 1998, 1-1951. [all data]
Sato, Watanabe, et al., 1991
Sato, H.; Watanabe, K.; Levelt Sengers, J.M.H.; Gallagher, J.S.; Hill, P.G.; Straub, J.; Wagner, W.,
Sixteen Thousand Evaluated Experimental Thermodynamic Property Data for Water and Steam,
J. Phys. Chem. Ref. Data, 1991, 20, 1023. [all data]
Brunner, 1990
Brunner, E.,
Fluid Mixtures at High Pressures. 9. Phase Separation and Critical Phenomena in 23 (n-Alkane + Water) Mixtures.,
J. Chem. Thermodyn., 1990, 22, 335. [all data]
Morita, Sato, et al., 1989
Morita, T.; Sato, H.; Uematsu, M.; Watanabe, K.,
PVT Properties and Vapor-Pressures of Ordinary Water Substance in the Critical Region,
Physica A: (Amsterdam), 1989, 156, 436. [all data]
Aleksandrov, 1986
Aleksandrov, A.A.,
Critical Parameters of Ordinary and Heavy Water,
Teploenergetika, 1986, No. 1, 74. [all data]
Sifner, 1985
Sifner, O.,
Recommended Values of Critical Parameters of Ordinary and Heavy Water,
Chem. Listy, 1985, 79, 199. [all data]
Liu and Lindsay, 1970
Liu, C.-T.; Lindsay, W.T., Jr.,
Vapor Pressure of D2O from 106 to 300 ºC,
J. Chem. Eng. Data, 1970, 15, 4, 510-513, https://doi.org/10.1021/je60047a015
. [all data]
Bridgeman and Aldrich, 1964
Bridgeman, O.C.; Aldrich, E.W.,
Vapor Pressure Tables for Water,
J. Heat Transfer, 1964, 86, 2, 279-286, https://doi.org/10.1115/1.3687121
. [all data]
Gubkov, Fermor, et al., 1964
Gubkov, A.N.; Fermor, N.A.; Smirnov, N.I.,
Vapor Pressure of Mono-Poly Systems,
Zh. Prikl. Khim. (Leningrad), 1964, 37, 2204-2210. [all data]
Stull, 1947
Stull, Daniel R.,
Vapor Pressure of Pure Substances. Organic and Inorganic Compounds,
Ind. Eng. Chem., 1947, 39, 4, 517-540, https://doi.org/10.1021/ie50448a022
. [all data]
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G.,
Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update,
J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018
. [all data]
Snow and Thomas, 1990
Snow, K.B.; Thomas, T.F.,
Mass spectrum, ionization potential, and appearance potentials for fragment ions of sulfuric acid vapor,
Int. J. Mass Spectrom. Ion Processes, 1990, 96, 49. [all data]
Page, Larkin, et al., 1988
Page, R.H.; Larkin, R.J.; Yhen, Y.R.; Lee, Y.T.,
High-resolution photoionization spectrum of water molecules in a supersonic beam,
J. Chem. Phys., 1988, 88, 2249. [all data]
Reutt, Wang, et al., 1986
Reutt, J.E.; Wang, L.S.; Lee, Y.T.; Shirley, D.A.,
Molecular beam photoelectron spectroscopy and femtosecond intramolecular dynamics of H2O+ and D2O+,
J. Chem. Phys., 1986, 85, 6928. [all data]
Grade, Wienecke, et al., 1983
Grade, M.; Wienecke, J.; Rosinger, W.; Hirschwald, W.,
Electron impact investigation of the molecules SeS(g) and TeSe(g) under high-temperature equilibrium conditions,
Ber. Bunsen-Ges. Phys. Chem., 1983, 87, 355. [all data]
Lefaivre and Marmet, 1978
Lefaivre, D.; Marmet, P.,
Electroionization of D2O and H2O and study of fragments H+ and OH+,
Can. J. Phys., 1978, 56, 1549. [all data]
Gurtler, Saile, et al., 1977
Gurtler, P.; Saile, V.; Koch, E.E.,
Rydberg series in the absorption spectra of H2O and D2O in the vacuum ultraviolet,
Chem. Phys. Lett., 1977, 51, 386. [all data]
Botter and Carlier, 1977
Botter, R.; Carlier, J.,
Spectre de photoelectrons et calcul des facteurs de Franck-Condon pour H2O, D2O, HDO,
J. Electron Spectrosc. Relat. Phenom., 1977, 12, 55. [all data]
Kronebusch and Berkowitz, 1976
Kronebusch, P.L.; Berkowitz, J.,
Photodissociative ionization in the 21-41 eV region: O2, N2, CO, NO, CO2, H2O, NH3 and CH4,
Int. J. Mass Spectrom. Ion Phys., 1976, 22, 283. [all data]
Dixon, Duxbury, et al., 1976
Dixon, R.N.; Duxbury, G.; Rabalais, J.W.; Asbrink, L.,
Rovibronic structure in the photoelectron spectra of H2O, D2O and HDO,
Mol. Phys., 1976, 31, 423. [all data]
Karlsson, Mattson, et al., 1975
Karlsson, L.; Mattson, L.; Jadrny, R.; Albridge, R.G.; Pinchas, S.; Bergmark, T.; Siegbahn, K.,
Isotopic and vibronic coupling effects in the valence electron spectra of H216O, H218O, and D216O,
J. Chem. Phys., 1975, 62, 4745. [all data]
Debies and Rabalais, 1975
Debies, T.P.; Rabalais, J.W.,
Calculated photoionization cross-sections and angular distributions for the isoelectronic series Ne, HF, H2O, NH3, and CH4,
J. Am. Chem. Soc., 1975, 97, 487. [all data]
Rabalais, Debies, et al., 1974
Rabalais, J.W.; Debies, T.P.; Berkosky, J.L.; Huang, J.-T.J.; Ellison, F.O.,
Calculated photoionization cross sections relative experimental photoionization intensities for a selection of small molecules,
J. Chem. Phys., 1974, 61, 516. [all data]
Bergmark, Karlsson, et al., 1974
Bergmark, T.; Karlsson, L.; Jadrny, R.; Mattsson, L.; Albridge, R.G.; Siegbahn, K.,
Isotopic effects in the electron spectra of H216O, H218O, and D216O,
J. Electron Spectrosc. Relat. Phenom., 1974, 4, 85. [all data]
Robin and Kuebler, 1973
Robin, M.B.; Kuebler, N.A.,
Excited electronic states of the simple alcohols,
J. Electron Spectrosc. Relat. Phenom., 1973, 1, 13. [all data]
Morrison and Traeger, 1973
Morrison, J.D.; Traeger, J.C.,
Ionization and dissociation by electron impact. I. H2O and H2S,
Int. J. Mass Spectrom. Ion Phys., 1973, 11, 77. [all data]
Katayama, Huffman, et al., 1973
Katayama, D.H.; Huffman, R.E.; O'Bryan, C.L.,
Absorption and photoionization cross sections for H2O and D2O in the vacuum ultraviolet,
J. Chem. Phys., 1973, 59, 4309. [all data]
Potts and Price, 1972
Potts, A.W.; Price, W.C.,
Photoelectron spectra and valence shell orbital structures of groups V VI hydrides,
Proc. R. Soc. London A:, 1972, 326, 181. [all data]
Asbrink and Rabalais, 1971
Asbrink, L.; Rabalais, J.W.,
Comments on the high resolution photoelectron spectrum of H2O and D2O,
Chem. Phys. Lett., 1971, 12, 182. [all data]
Cermak, 1968
Cermak, V.,
Penning ionization electron spectroscopy. I. Determination of ionization potentials of polyatomic molecules,
Collection Czech. Chem. Commun., 1968, 33, 2739. [all data]
Brundle and Turner, 1968
Brundle, C.R.; Turner, D.W.,
High resolution molecular photoelectron spectroscopy. II.Water and deuterium oxide,
Proc. Roy. Soc. (London), 1968, A307, 27. [all data]
Dibeler, Walker, et al., 1966
Dibeler, V.H.; Walker, J.A.; Rosenstock, H.M.,
Mass spectrometric study of photoionization. V.Water and ammonia,
J.Res. NBS, 1966, 70A, 459. [all data]
Brehm, 1966
Brehm, B.,
Massenspektrometrische Untersuchung der Photoionisation von Molekulen,
Z. Naturforsch., 1966, 21a, 196. [all data]
Nicholson, 1965
Nicholson, A.J.C.,
Photoionization-efficiency curves. II. False and genuine structure,
J. Chem. Phys., 1965, 43, 1171. [all data]
Frost and McDowell, 1958
Frost, D.C.; McDowell, C.A.,
Excited states of the molecular ions of hydrogen fluoride, hydrogen iodide, water, hydrogen sulphide, and ammonia,
Can. J. Chem., 1958, 36, 39. [all data]
Price, 1936
Price, W.C.,
The far ultraviolet absorption spectra and ionization potentials of H2O and H2S,
J. Chem. Phys., 1936, 4, 147. [all data]
Kimura, Katsumata, et al., 1981
Kimura, K.; Katsumata, S.; Achiba, Y.; Yamazaki, T.; Iwata, S.,
Ionization energies, Ab initio assignments, and valence electronic structure for 200 molecules
in Handbook of HeI Photoelectron Spectra of Fundamental Organic Compounds, Japan Scientific Soc. Press, Tokyo, 1981. [all data]
Campbell, Liesegang, et al., 1979
Campbell, M.J.; Liesegang, J.; Riley, J.D.; Leckey, R.C.G.; Jenkin, J.G.; Poole, R.T.,
The electronic structure of the valence bands of solid NH3 and H2O studied by ultraviolet photoelectron spectroscopy,
J. Electron Spectrosc. Relat. Phenom., 1979, 15, 83. [all data]
Benoit and Harrison, 1977
Benoit, F.M.; Harrison, A.G.,
Predictive value of proton affinity. Ionization energy correlations involving oxygenated molecules,
J. Am. Chem. Soc., 1977, 99, 3980. [all data]
Wieczorek, Koenig, et al., 1975
Wieczorek, J.S.; Koenig, T.; Balle, T.,
The He(I) photoelectron spectra of amine n-oxides,
J. Electron Spectrosc. Relat. Phenom., 1975, 6, 215. [all data]
Banna and Shirley, 1975
Banna, M.S.; Shirley, D.A.,
Molecular photoelectron spectroscopy at 132.3 eV. The second-row hydrides,
J. Chem. Phys., 1975, 63, 4759. [all data]
Schweig and Thiel, 1974
Schweig, A.; Thiel, W.,
Photoionization cross sections: He I- and He II-photoelectron spectra of homologous oxygen and sulphur compounds,
Mol. Phys., 1974, 27, 265. [all data]
Appell and Durup, 1973
Appell, J.; Durup, J.,
The formation of protons by impact of low energy electrons on water molecules,
Int. J. Mass Spectrom. Ion Phys., 1973, 10, 247. [all data]
Cottin, 1959
Cottin, M.,
Etude des ions produits par impact electronique dans la vapeur d'eau,
J. Chim. Phys., 1959, 56, 1024. [all data]
McCulloh, 1976
McCulloh, K.E.,
Energetics and mechanisms of fragment ion formation in the photoionization of normal and deuterated water and ammonia,
Int. J. Mass Spectrom. Ion Phys., 1976, 21, 333. [all data]
Foner and Hudson, 1956
Foner, S.N.; Hudson, R.L.,
Ionization potential of the OH free radical by mass spectrometry,
J. Chem. Phys., 1956, 25, 602. [all data]
Ehrhardt and Kresling, 1967
Ehrhardt, H.; Kresling, A.,
Die dissoziative Ionisation von N2, O2, H2O, CO2 und Athan,
Z. Naturforsch., 1967, 22a, 2036. [all data]
Smith, Kim, et al., 1997
Smith, J.R.; Kim, J.B.; Lineberger, W.C.,
High-resolution Threshold Photodetachment Spectroscopy of OH-,
Phys. Rev. A, 1997, 55, 3, 2036, https://doi.org/10.1103/PhysRevA.55.2036
. [all data]
Check, Faust, et al., 2001
Check, C.E.; Faust, T.O.; Bailey, J.M.; Wright, B.J.; Gilbert, T.M.; Sunderlin, L.S.,
Addition of Polarization and Diffuse Functions to the LANL2DZ Basis Set for P-Block Elements,
J. Phys. Chem. A,, 2001, 105, 34, 8111, https://doi.org/10.1021/jp011945l
. [all data]
Holland and Castleman, 1982
Holland, P.M.; Castleman, A.W.,
The Thermochemical Properties of Gas - Phase Transition Metal Ion Complexes,
J. Chem. Phys., 1982, 76, 8, 4195, https://doi.org/10.1063/1.443497
. [all data]
Dalleska, Tjelta, et al., 1994
Dalleska, N.F.; Tjelta, B.L.; Armentrout, P.B.,
Sequential Bond Energies of Water to Na+ (3s0), Mg+ (3s1), and Al+ (3s2),
J. Phys. Chem., 1994, 98, 15, 4191, https://doi.org/10.1021/j100066a045
. [all data]
Tang and Castleman, 1974
Tang, I.N.; Castleman, A.W.,
Mass Spectrometric Study of Gas - Phase Clustering Reactions: Hydration of the Monovalent Bismuth Ion,
J. Chem. Phys., 1974, 60, 10, 3981, https://doi.org/10.1063/1.1680846
. [all data]
Markovich, Pollack, et al., 1994
Markovich, G.; Pollack, S.; Giniger, R.; Cheshnovsky, O.,
Photoelectron spectroscopy of Cl-, Br-, and I- solvated in water clusters,
J. Chem. Phys., 1994, 101, 11, 9344, https://doi.org/10.1063/1.467965
. [all data]
Hiraoka, Mizuse, et al., 1988
Hiraoka, K.; Mizuse, S.; Yamabe, S.,
Solvation of Halide Ions with H2O and CH3CN in the Gas Phase,
J. Phys. Chem., 1988, 92, 13, 3943, https://doi.org/10.1021/j100324a051
. [all data]
Arshadi, Yamdagni, et al., 1970
Arshadi, M.; Yamdagni, R.; Kebarle, P.,
Hydration of Halide Negative Ions in the Gas Phase. II. Comparison of Hydration Energies for the Alkali Positive and Halide Negative Ions,
J. Phys. Chem., 1970, 74, 7, 1475, https://doi.org/10.1021/j100702a014
. [all data]
Caldwell, Masucci, et al., 1989
Caldwell, G.W.; Masucci, J.A.; Ikonomou, M.G.,
Negative Ion Chemical Ionization Mass Spectrometry - Binding of Molecules to Bromide and Iodide Anions,
Org. Mass Spectrom., 1989, 24, 1, 8, https://doi.org/10.1002/oms.1210240103
. [all data]
Burdett and Hayhurst, 1982
Burdett, N.A.; Hayhurst, A.N.,
Hydration of gas phase ions and the measurement of boundary layer cooling during flame sampling into a mass spectrometer.,
J. Chem. Soc. Faraday Trans. 1, 1982, 78, 2997. [all data]
Payzant, Yamdagni, et al., 1971
Payzant, J.D.; Yamdagni, R.; Kebarle, P.,
Hydration of CN-, NO2-, NO3-, and HO- in the gas phase,
Can. J. Chem., 1971, 49, 3308. [all data]
Kebarle, Arshadi, et al., 1968
Kebarle, P.; Arshadi, M.; Scarborough, J.,
Hydration of Negative Ions in the Gas Phase,
J. Chem. Phys., 1968, 49, 2, 817, https://doi.org/10.1063/1.1670145
. [all data]
Bennet and Field, 1972
Bennet, S.L.; Field, F.H.,
Reversible Reactions of Gaseous Ions. VI. The NH3 - CH4, H2S - CH4 and CF4 - CH4 Systems at Low Temperatures,
J. Am. Chem. Soc., 1972, 94, 18, 6305, https://doi.org/10.1021/ja00773a009
. [all data]
Amelynck, Van Bavel, et al., 2000
Amelynck, C.; Van Bavel, A.M.; Schoon, N.; Arijs, E.,
Gas phase reactions of CF3O- and CF3O-center dot H2O and their relevance to the detection of stratospheric HCl,
Int. J. Mass Spectrom., 2000, 202, 1-3, 207-216, https://doi.org/10.1016/S1387-3806(00)00244-X
. [all data]
Blades, Klassen, et al., 1995
Blades, A.T.; Klassen, J.S.; Kebarle, P.,
Free Energies of Hydration in the Gas Phase on the Anions of Some Oxo Acids of C, N, S, P, Cl and I,
J. Am. Chem. Soc., 1995, 117, 42, 10563, https://doi.org/10.1021/ja00147a019
. [all data]
Meot-Ner and Sieck, 1986
Meot-Ner, M.; Sieck, L.W.,
The ionic hydrogen bond and ion solvation. 5. OH...O- bonds. Gas phase solvation and clustering of alkoxide and carboxylate anions,
J. Am. Chem. Soc., 1986, 108, 7525. [all data]
Viidanoja, Reiner, et al., 2000
Viidanoja, J.; Reiner, T.; Kiendler, A.; Grimm, F.; Arnold, F.,
Laboratory investigations of negative ion molecule reactions of propionic, butyric, glyoxylic, pyruvic, and pinonic acids,
Int. J. Mass Spectrom., 2000, 194, 1, 53-68, https://doi.org/10.1016/S1387-3806(99)00172-4
. [all data]
Keesee, Lee, et al., 1979
Keesee, R.G.; Lee, N.; Castleman Jr.,
Properties of Clusters in the Gas Phase. 3. Hydration Complexes of CO3- and HCO3-,
J. Am. Chem. Soc., 1979, 101, 10, 2599, https://doi.org/10.1021/ja00504a015
. [all data]
Meot-Ner (Mautner) and Speller, 1989
Meot-Ner (Mautner), M.; Speller, C.V.,
Multicomponent Cluster Ions.3. Comparative Stabilities of Cationic and Anionic Hydrogen Bonded Networks. Mixed Clusters of Water and Hydrogen Cyanide,
J. Phys. Chem., 1989, 93, 6580. [all data]
Berman and Beauchamp, 1980
Berman, D.W.; Beauchamp, J.L.,
A Novel Bimolecular Reaction Sequence Yielding H(OH2)2+ at Low Pressures. Ion Cyclotron Resonance Studies of the Reaction of Doubly Solvated Protons,
J. Phys. Chem., 1980, 84, 18, 2233, https://doi.org/10.1021/j100455a004
. [all data]
Lias, Liebman, et al., 1984
Lias, S.G.; Liebman, J.F.; Levin, R.D.,
Evaluated gas phase basicities and proton affinities of molecules heats of formation of protonated molecules,
J. Phys. Chem. Ref. Data, 1984, 13, 695. [all data]
Fehsenfeld, Dotan, et al., 1978
Fehsenfeld, F.C.; Dotan, I.; Albritton, D.L.; Howard, C.J.; Ferguson, E.E.,
Stratospheric Positive Ion Chemistry of Formaldehyde and Methanol,
J. Geophys. Res., 1978, 83, C3, 1333, https://doi.org/10.1029/JC083iC03p01333
. [all data]
Meot-Ner (Mautner), 1992
Meot-Ner (Mautner), M.,
Intermolecular Forces in Organic Clusters,
J. Am. Chem. Soc., 1992, 114, 9, 3312, https://doi.org/10.1021/ja00035a024
. [all data]
Surber and Sanov, 2002
Surber, E.; Sanov, A.,
Photoelectron imaging spectroscopy of molecular and cluster anions: CS2- and OCS-(H2O)(1,2),
J. Chem. Phys., 2002, 116, 14, 5921-5924, https://doi.org/10.1063/1.1467916
. [all data]
Meot-Ner (Mautner), 1984
Meot-Ner (Mautner), M.,
The Ionic Hydrogen Bond and Ion Solvation. 2. Hydration of Onium Ions by 1 - 7 H2O Molecules. Relations Between Monomolecular, Specific and Bulk Hydration,
J. Am. Chem. Soc., 1984, 106, 5, 1265, https://doi.org/10.1021/ja00317a016
. [all data]
Davidson, Sunner J., et al., 1979
Davidson, W.R.; Sunner J.; Kebarle, P.,
Hydrogen Bonding of Water to Onium Ions. Hydration of Substituted Pyridinium Ions and Related Systems,
J. Am. Chem. Soc., 1979, 101, 7, 1675, https://doi.org/10.1021/ja00501a005
. [all data]
Larson and McMahon, 1982
Larson, J.W.; McMahon, T.B.,
Formation, Thermochemistry, and Relative Stabilities of Proton - Bound dimers of Oxygen n - Donor Bases from Ion Cyclotron Resonance Solvent - Exchange Equilibria Measurements,
J. Am. Chem. Soc., 1982, 104, 23, 6255, https://doi.org/10.1021/ja00387a016
. [all data]
Grimsrud and Kebarle, 1973
Grimsrud, E.P.; Kebarle, P.,
Gas Phase Ion Equilibria Studies of the Solvation of the Hydrogen Ion by Methanol, Dimethyl Ether and Water. Effect of Hydrogen Bonding,
J. Am. Chem. Soc., 1973, 95, 24, 7939, https://doi.org/10.1021/ja00805a002
. [all data]
Yamdagni and Kebarle, 1976
Yamdagni, R.; Kebarle, P.,
Gas Phase Basicities and Proton Affinities of Compounds Between Water Ammonia and Substituted Benzenes from a Continuous Ladder of Proton Transfer Equilibrium Measurements,
J. Am. Chem. Soc., 1976, 98, 6, 1320, https://doi.org/10.1021/ja00422a005
. [all data]
Wolf, Staley, et al., 1977
Wolf, J.F.; Staley, R.H.; Koppel, I.; Taagepera, M.; McIver, R.T.; Beauchamp, J.L.; Taft, R.W.,
Gas Phase Basicities and Relative Proton Affinities of Compounds Between Water and Ammonia from Pulsed Ion Cyclotron Resonance Thermal Equilibria Measurements,
J. Am. Chem. Soc., 1977, 99, 16, 5417, https://doi.org/10.1021/ja00458a032
. [all data]
Bohme, Mackay, et al., 1979
Bohme, D.K.; Mackay, G.I.; Tanner, S.D.,
An Experimental Study of the Gas - Phase Kinetics of Reactions with Hydrated H3O+ Ions (n=1 - 3) at 298 K,
J. Am. Chem. Soc., 1979, 101, 14, 3724, https://doi.org/10.1021/ja00508a003
. [all data]
Meot-Ner(Mautner), 1986
Meot-Ner(Mautner), M.,
Comparative Stabilities of Cationic and Anionic Hydrogen-Bonded Networks. Mixed Clusters of Water-Methanol,
J. Am. Chem. Soc., 1986, 108, 20, 6189, https://doi.org/10.1021/ja00280a014
. [all data]
DeTuri and Ervin, 1999
DeTuri, V.F.; Ervin, K.M.,
Competitive threshold collision-induced dissociation: Gas-phase acidities and bond dissociation energies for a series of alcohols,
J. Phys. Chem. A, 1999, 103, 35, 6911-6920, https://doi.org/10.1021/jp991459m
. [all data]
Meot-ner and Sieck, 1986
Meot-ner, M.; Sieck, L.W.,
Relative acidities of water and methanol, and the stabilities of the dimer adducts,
J. Phys. Chem., 1986, 90, 6687. [all data]
MacKay and Bohme, 1978
MacKay, G.I.; Bohme, D.K.,
Proton-Transfer Reactions in Nitromethane at 297K,
Int. J. Mass Spectrom. Ion Phys., 1978, 26, 4, 327, https://doi.org/10.1016/0020-7381(78)80052-7
. [all data]
Sieck and Meot-ner, 1989
Sieck, L.W.; Meot-ner, M.,
Ionic Hydrogen Bond and Ion Solvation. 8. RS-..HOR Bond Strengths. Correlation with Acidities.,
J. Phys. Chem., 1989, 93, 4, 1586, https://doi.org/10.1021/j100341a079
. [all data]
Meot-Ner, 1984
Meot-Ner, (Mautner),
The Ionic Hydrogen Bond. 4. Intramolecular and Multiple Bonds. Proton Affinities, Hydration and Complexes of Amides and Amino Acid Derivatives,
J. Am. Chem. Soc., 1984, 106, 2, 278, https://doi.org/10.1021/ja00314a003
. [all data]
Hiraoka, Takimoto, et al., 1986
Hiraoka, K.; Takimoto, H.; Morise, K.,
Gas-Phase Hydration Reactions of Protonated Alcohols. Energetics and Bulk Hydration of Cluster Ions,
J. Am. Chem. Soc., 1986, 108, 19, 5683, https://doi.org/10.1021/ja00279a004
. [all data]
Meot-Ner (Mautner) and Sieck, 1985
Meot-Ner (Mautner), M.; Sieck, L.W.,
The Ionic Hydrogen Bond and Ion Solvation. 4. SH+ O and NH+ S Bonds. Correlations with Proton Affinity. Mutual Effects of Weak and Strong Ligands in Mixed Clusters,
J. Phys. Chem., 1985, 89, 24, 5222, https://doi.org/10.1021/j100270a021
. [all data]
Berman and Beauchamp, 1986
Berman, D.W.; Beauchamp, J.L.,
Quoted in Keesee and Castleman, 1986, 1986. [all data]
Lau and Kebarle, 1981
Lau, Y.K.; Kebarle, P.,
Hydrogen Bonding Solvent Effect on the Basicity of Primary Amines CH3NH2, C2H5NH2, AND CF3CH2NH2,
Can. J. Chem., 1981, 59, 1, 151, https://doi.org/10.1139/v81-024
. [all data]
Banic and Iribarne, 1985
Banic, C.M.; Iribarne, J.V.,
Equilibrium Constants for Clustering of Neutral Molecules about Gaseous Ions,
J. Chem. Phys., 1985, 83, 12, 6432, https://doi.org/10.1063/1.449543
. [all data]
Meot-Ner (Mautner) M. and Speller, 1989
Meot-Ner (Mautner) M.; Speller, C.V.,
Multicomponent Cluster Ions. 2. Comparative Stabilities of Cationic and Anionic Hydrogen Bonded Networks. Mixed Clusters of Water and Hydrogen Cyanide,
J. Phys. Chem., 1989, 93, 9, 3663, https://doi.org/10.1021/j100346a058
. [all data]
Larson, Szulejko, et al., 1988
Larson, J.W.; Szulejko, J.E.; McMahon, T.B.,
Gas Phase Lewis Acid-Base Interactions. An Experimental Determination of Cyanide Binding Energies From Ion Cyclotron Resonance and High-Pressure Mass Spectrometric Equilibrium Measurements.,
J. Am. Chem. Soc., 1988, 110, 23, 7604, https://doi.org/10.1021/ja00231a004
. [all data]
Meot-ner, 1988
Meot-ner, M.,
The Ionic Hydrogen Bond and Solvation. 7. Interaction Energies of Carbanions with Solvent Molecules,
J. Am. Chem. Soc., 1988, 110, 12, 3858, https://doi.org/10.1021/ja00220a022
. [all data]
Meot-ner, 1988, 2
Meot-ner, M.,
Ionic Hydrogen Bond and Ion Solvation. 6. Interaction Energies of the Acetate Ion with Organic Molecules. Comparison of CH3COO- with Cl-, CN-, and SH-,
J. Am. Chem. Soc., 1988, 110, 12, 3854, https://doi.org/10.1021/ja00220a022
. [all data]
Fehsenfeld and Ferguson, 1974
Fehsenfeld, F.C.; Ferguson, E.E.,
Laboratory studies of negative ion reactions with atmospheric trace constituents,
J. Chem. Phys., 1974, 61, 3181. [all data]
Smith, Lee, et al., 1978
Smith, G.P.; Lee, L.C.; Cosby, P.C.; Peterson, J.R.; Moseley, J.T.,
Photodissociation and photodetachment of molecular negative ions. V. Atmospheric ions from 7000 to 8400 A),
J. Chem. Phys., 1978, 68, 3818. [all data]
Cunningham, Payzant, et al., 1972
Cunningham, A.J.; Payzant, J.D.; Kebarle, P.,
A Kinetic Study of the Proton Hydrate H+(H2O)n Equilibria in the Gas Phase,
J. Am. Chem. Soc., 1972, 94, 22, 7627, https://doi.org/10.1021/ja00777a003
. [all data]
Keesee and Castleman, 1986
Keesee, R.G.; Castleman, A.W., Jr.,
Thermochemical data on Ggs-phase ion-molecule association and clustering reactions,
J. Phys. Chem. Ref. Data, 1986, 15, 1011. [all data]
Postma, Ruttink, et al., 1986
Postma, R.; Ruttink, P.; Terlouw, J.; Holmes, J.,
The ketene-water radical cation dipole complex [CH2CO.H2O]+,
J. Chem. Soc., Chem. Commun., 1986, 683. [all data]
Davidson, Lau, et al., 1978
Davidson, W.R.; Lau, Y.K.; Kebarle, P.,
Gas Phase Dissociation of Protonated Acetic Acid to the Acyl Cation and Water. Heat of Formation of CH3CO+ and Proton Affinity of Ketene,
Can. J. Chem., 1978, 56, 7, 1016, https://doi.org/10.1139/v78-170
. [all data]
Meot-Ner (Mautner), 1988
Meot-Ner (Mautner), M.,
Models for Strong Interactions in Proteins and Enzymes. 2. Interactions of Ions with the Peptide Link and Imidazole,
J. Am. Chem. Soc., 1988, 110, 10, 3075, https://doi.org/10.1021/ja00218a014
. [all data]
Wincel, 2008
Wincel, H.,
Hydration energies of deprotonated amino acids from gas phase equilibria measurements,
J. Am. Soc. Mass Spectrom., 2008, 19, 8, 1091-1097, https://doi.org/10.1016/j.jasms.2008.05.014
. [all data]
Meot-ner, Elmore, et al., 1999
Meot-ner, M.; Elmore, D.E.; Scheiner, S.,
Ionic Hydrogen Bond Effects on the Acidities, Basicities, Solvation, Solvent Bridging and Self-assembly of Carboxylic Groups,
J. Am. Chem. Soc., 1999, 121, 33, 7625, https://doi.org/10.1021/ja982173i
. [all data]
Deakyne, Meot-Ner (Mautner), et al., 1986
Deakyne, C.A.; Meot-Ner (Mautner), M.; Campbell, C.L.; Hughes, M.G.; Murphy, S.P.,
Multicomponent Cluster Ions. 1. The Acetonitrile - Water System,
J. Chem. Phys., 1986, 90, 4648. [all data]
Honma, Sunderlin, et al., 1993
Honma, K.; Sunderlin, L.S.; Armentrout, P.B.,
Guided-Ion Beam Studies of the Reactions of Protonated Water Clusters, H(H2O)n+ (n = 1-4), with Acetonitrile,
J. Chem. Phys., 1993, 99, 3, 1623, https://doi.org/10.1063/1.465331
. [all data]
Speller and Meot-Ner (Mautner), 1985
Speller, C.V.; Meot-Ner (Mautner), M.,
The Ionic Hydrogen Bond and Ion Solvation. 3. Bonds Involving Cyanides. Correlations with Proton Affinites,
J. Phys. Chem., 1985, 81, 24, 5217, https://doi.org/10.1021/j100270a020
. [all data]
Nieckarz, Atkins, et al., 2008
Nieckarz, R.J.; Atkins, C.G.; McMahon, T.B.,
Effects of Isomerization on the Measured Thermochemical Properties of Deprotonated Glycine/Protic-Solvent Clusters,
Chemphyschem, 2008, 9, 18, 2816-2825, https://doi.org/10.1002/cphc.200800525
. [all data]
Klassen, Blades, et al., 1995
Klassen, J.S.; Blades, A.T.; Kebarle, P.,
Determinations of Ion-Molecule Equilibria Involving Ions Produced by Electrospray. Hydration of Protonated Amines, Diamines, and Some Small Peptides,
J. Phys. Chem., 1995, 99, 42, 15509, https://doi.org/10.1021/j100042a027
. [all data]
Hiraoka, Grimsrud, et al., 1974
Hiraoka, K.; Grimsrud, E.P.; Kebarle, P.,
Gas Phase Ion Equilibria Studies of the Hydrogen Ion in Water - Dimethyl Ether and Methanol - Dimethyl Ether Mixtures,
J. Am. Chem. Soc., 1974, 96, 11, 3359, https://doi.org/10.1021/ja00818a004
. [all data]
Tholman, Tonner, et al., 1994
Tholman, D.; Tonner, D.S.; McMahon, T.B.,
Spontaneous Unimolecular Dissociation of Small Cluster Ions, (H3O)+(L)n and Cl-(H2O)n (n = 2-4), under Fourier Transform Ion Cyclotron Resonance Conditions,
J. Phys. Chem., 1994, 98, 8, 2002, https://doi.org/10.1021/j100059a002
. [all data]
Kebarle, 1977
Kebarle, P.,
Ion Thermochemistry and Solvation from Gas Phase Ion Equilibria,
Ann. Rev. Phys. Chem., 1977, 28, 1, 445, https://doi.org/10.1146/annurev.pc.28.100177.002305
. [all data]
Davidson, Meza-Hojer, et al., 1979
Davidson, W.R.; Meza-Hojer, S.; Kebarle, P.,
Gas Phase Ion Equilibria: RCO+ + OH2 ---> RC(OH)2+; Heats of Formation of Acylium Ions RCO+ and Protonated Acids RC(OH)2+; Gas Phase Catalysis of Proton Shift RC(OH)2+ ---> RCO(OH2)+,
Can. J. Chem., 1979, 57, 24, 3205, https://doi.org/10.1139/v79-525
. [all data]
Hiraoka and Kebarle, 1977
Hiraoka, K.; Kebarle, P.,
Condensation reactions involving carbonium ions in the gas phase synthesis of protonated acids in gaseous methane containing carbon monoxide and water vapor,
J. Am. Chem. Soc., 1977, 99, 366. [all data]
Holmes, Mommers, et al., 1984
Holmes, J.L.; Mommers, A.A.; Szulejko, J.E.; Terlouw, J.K.,
Two new stable [C3H8O]+ isomers: The radical cations [C3H6OH2]+,
J. Chem. Soc., Chem. Commun., 1984, 165. [all data]
Shao, Baer, et al., 1987
Shao, J.D.; Baer, T.; Morrow, J.C.; Frasier-Monterio, M.L.,
The Dissociation Dynamics of Energy Selected Ion-Dipole Complexes. 1. The Cyclopropane Ion - Water Complex [C-C3H6 - OH2],
J. Chem. Phys., 1987, 87, 9, 5242, https://doi.org/10.1063/1.453693
. [all data]
Beggs and Field, 1971
Beggs, D.P.; Field, F.H.,
Reversible Reactions of Gas Phase Ions. II. Propane-Water System,
J. Am. Chem. Soc., 1971, 93, 7, 1576, https://doi.org/10.1021/ja00736a002
. [all data]
Meot-Ner (Mautner), Ross, et al., 1985
Meot-Ner (Mautner), M.; Ross, M.M.; Campana, J.E.,
Stable Hydrogen - Bonded Isomers of Covalent Ions,
J. Am. Chem. Soc., 1985, 107, 4835. [all data]
Stone and Wojtyniak, 1986
Stone, A.J.; Wojtyniak, A.C.M.,
The Condensation of Trimethylsilylium with Water and the Proton Affinity of Trimethylsilanol,
Can. J. Chem., 1986, 64, 3, 575, https://doi.org/10.1139/v86-092
. [all data]
Stone and Wytenberg, 1987
Stone, J.A.; Wytenberg, W.J.,
The Binding Energies of Trialkylgermanium Cations to Water Molecules Studied by High Pressure Mass Spectrometry,
Can. J. Chem., 1987, 65, 9, 2146, https://doi.org/10.1139/v87-358
. [all data]
Stone and Splinter, 1984
Stone, J.A.; Splinter, D.E.,
A high-pressure mass spectrometric study of the binding of (CH3)3Sn+ to lewis bases in the gas phase,
Int. J. Mass Spectrom. Ion Processes, 1984, 59, 169. [all data]
El-Shall, Daly, et al., 1992
El-Shall, M.S.; Daly, G.M.; Gao, J.; Meot-Ner (Mautner), M.; Sieck, L.W.,
How Sensitive are Cluster Compositions to Energetics? A Joint Beam Expansion/ Thermochemical Study of Water - Methanol - Trimethylamine Clusters,
J. Phys. Chem., 1992, 96, 2, 507, https://doi.org/10.1021/j100181a002
. [all data]
Meot-Ner M. and Sieck, 1983
Meot-Ner M.; Sieck, L.W.,
The Ionic Hydrogen Bond. 1. Sterically Hindered Bonds. Solvation and Clustering of Sterically Hindered Amines and Pyridines,
J. Am. Chem. Soc., 1983, 105, 10, 2956, https://doi.org/10.1021/ja00348a005
. [all data]
Blades, Klassen, et al., 1996
Blades, A.T.; Klassen, J.S.; Kebarle, P.,
Determination of Ion-Solvent Equilibria in the Gas Phase. Hydration of Diprotonated Diamines and Bis(trimethylammonium) Alkanes,
J. Am. Chem. Soc., 1996, 118, 49, 12437, https://doi.org/10.1021/ja962641t
. [all data]
Hiraoka, Takimoto, et al., 1987
Hiraoka, K.; Takimoto, H.; Yamabe, S.,
Stabilities and Structures in Cluster Ions of Five-Membered Heterocyclic Compounds Containing O, N and S Atoms,
J. Am. Chem. Soc., 1987, 109, 24, 7346, https://doi.org/10.1021/ja00258a018
. [all data]
Nicol, Sunner, et al., 1988
Nicol, G.; Sunner, J.; Kebarle, P.,
Kinetics and Thermodynamics of Protonation Reactions: H3O+(H2O)h + B = BH+(H2O)b + (h - b +1)H2O, where B is a Nitrogen, Oxygen or Carbon Base,
Int. J. Mass Spectrom. Ion Proc., 1988, 84, 1-2, 135, https://doi.org/10.1016/0168-1176(88)83032-5
. [all data]
Hiraoka and Kebarle, 1977, 2
Hiraoka, K.; Kebarle, P.,
Gas Phase Ion Equilibria Studies of the Proton in Hydrogen Sulfide and Hydrogen Sulfide - Water Mixtures. Stabilities of the Hydrogen Bonded Complexes H+(H2S)x(H2O)y,
Can. J. Chem., 1977, 55, 1, 24, https://doi.org/10.1139/v77-005
. [all data]
Hiraoka and Kebarle, 1977, 3
Hiraoka, K.; Kebarle, P.,
Condensation Reactions Involving Carbonium Ions and Lewis Bases in the Gas Phase. Hydration of the t - Butyl Cation,
J. Am. Chem., 1977, 99, 2, 360, https://doi.org/10.1021/ja00444a008
. [all data]
Meot-Ner (Mautner), Sieck, et al., 1994
Meot-Ner (Mautner), M.; Sieck, L.W.; Liebman, J.F.; Scheiner, S.; Duan, X.,
The Ionic Hydrogen Bond. 5. Polydentate and Solvent-Bridged Structures. Complexing of the Proton and the Hydronium Ions by Polyethers,
J. Am. Chem. Soc., 1994, 116, 17, 7848, https://doi.org/10.1021/ja00096a047
. [all data]
Ding, Wang, et al., 1998
Ding, C.F.; Wang, X.B.; Wang, L.S.,
Photoelectron spectroscopy of doubly charged anions: Intramolecular Coulomb repulsion and solvent stabilization,
J. Phys. Chem. A, 1998, 102, 45, 8633-8636, https://doi.org/10.1021/jp982698x
. [all data]
Meot-Ner and Field, 1974
Meot-Ner, (Mautner); Field, F.H.,
Solvation and Association of Protonated Gaseous Amino Acids,
J. Am. Chem. Soc., 1974, 96, 10, 3168, https://doi.org/10.1021/ja00817a024
. [all data]
Eustis, Wang, et al., 2007
Eustis, S.N.; Wang, D.; Bowen, K.H.; Patwari, G.N.,
Photoelectron spectroscopy of hydrated hexafluorobenzene anions,
J. Chem. Phys., 2007, 127, 11, 114312, https://doi.org/10.1063/1.2768349
. [all data]
Sieck, 1985
Sieck, L.W.,
Thermochemistry of Solvation of NO2- and C6H5NO2- by Polar Molecules in the Vapor Phase. Comparison with Cl- and Variation with Ligand Structure.,
J. Phys. Chem., 1985, 89, 25, 5552, https://doi.org/10.1021/j100271a049
. [all data]
Martinsen and Buttrill, 1978
Martinsen, D.P.; Buttrill, S.E.,
Hydrogen Bonding of Water to Gas - Phase Ions. Structural and Stereochemical Effects in Protonated Phenols,
J. Am. Chem. Soc., 1978, 100, 21, 6559, https://doi.org/10.1021/ja00489a002
. [all data]
Lau, Nishizawa, et al., 1981
Lau, Y.K.; Nishizawa, K.; Tse, A.; Brown, R.S.; Kebarle, P.,
Protonation and Site of Protonation in Anilines. Hydration and Site of Protonation after Hydration,
J. Am. Chem. Soc., 1981, 103, 21, 6291, https://doi.org/10.1021/ja00411a004
. [all data]
Field, 1969
Field, F.H.,
Chemical Ionization Mass Spectrometry. IX. Temperature and Pressure Studies with Benzyl Acetate and t-Amyl Acetate,
J. Am. Chem. Soc., 1969, 91, 11, 2827, https://doi.org/10.1021/ja01039a002
. [all data]
Buttrill, 1983
Buttrill, S.E.,
Quoted in 83TAF, 1983. [all data]
Blades, Ho, et al., 1996
Blades, A.T.; Ho, Y.; Kebarle, P.,
Free Energies of Hydration in the Gas Phase of Some Phosphate Singly and Doubly Charged Anions: orthophosphate, diphosphate, Ribose-5-phosphate, Adenosine-5'-phosphate and Adenosine-5'-Dipho,
J. Phys. Chem., 1996, 100, 6, 2443, https://doi.org/10.1021/jp952032s
. [all data]
Sharma and Kebarle, 1984
Sharma, R.B.; Kebarle, P.,
Stabilites and Hydrogen Bonding in Complexes of H3O+ and CH3OH2+ with Crown Ethers, from Measurements of Gas - Phase Ion - Molecule Equilibria,
J. Am. Chem. Soc., 1984, 106, 14, 3913, https://doi.org/10.1021/ja00326a005
. [all data]
Kokubo, Ando, et al., 2004
Kokubo, S.; Ando, N.; Koyasu, K.; Mitsui, M.; Nakajima, A.,
Negative ion photoelectron spectroscopy of acridine molecular anion and its monohydrate,
J. Chem. Phys., 2004, 121, 22, 11112-11117, https://doi.org/10.1063/1.1818132
. [all data]
Kochanski and Constantin, 1987
Kochanski, E.; Constantin, E.,
Theoretical and Experimental Studies of the System Ca+(H2O)n for n=1 to 10,
J. Chem. Phys., 1987, 87, 3, 1661, https://doi.org/10.1063/1.453229
. [all data]
Blades, Jayaweera, et al., 1990
Blades, A.T.; Jayaweera, P.; Ikonomou, M.G.; Kebarle, P.,
Studies of Alkaline - Earth and Transition - Metal M++ Gas - Phase Ion Chemistry,
J. Chem. Phys., 1990, 92, 10, 5900, https://doi.org/10.1063/1.458360
. [all data]
Evans and Keesee, 1991
Evans, D.H.; Keesee, R.G.,
Thermodynamics of Gas-Phase Mixed-Solvent Cluster Ions - Water and Methanol on K+ and Cl- and Comparison to Liquid Solutions,
J. Phys. Chem., 1991, 95, 9, 3558, https://doi.org/10.1021/j100162a024
. [all data]
Upschulte, Evans, et al., 1986
Upschulte, B.L.; Evans, D.H.; Keesee, R.G.; Castleman, A.W.,
Unpublished results, referred to in Keesee and Castleman, 1986, 1986. [all data]
Keesee and Castleman, 1980
Keesee, R.G.; Castleman, A.W., Jr.,
Gas phase studies of hydration complexes of Cl- and I- and comparison to electrostatic calculations in the gas phase,
Chem. Phys. Lett., 1980, 74, 139. [all data]
Hiraoka and Mizuse, 1987
Hiraoka, K.; Mizuse, S.,
Gas-Phase Solvation of Cl- with H2O, CH3OH, C2H4OH, i-C3H7OH, n-C3H7OH, and t-C4H9OH,
Chem. Phys., 1987, 118, 3, 457, https://doi.org/10.1016/0301-0104(87)85078-4
. [all data]
Upschulte, Schelling, et al., 1984
Upschulte, B.L.; Schelling, F.J.; Keesee, R.G.; Castleman, A.W.,
Thermochemical Properties of Gas Phase Mixed Clusters: Water and Sulfur Dioxide with Na+ and Cl-,
Chem. Phys. Lett., 1984, 111, 4-5, 389, https://doi.org/10.1016/0009-2614(84)85526-8
. [all data]
Tschurl and Boesl, 2007
Tschurl, M.; Boesl, U.,
Photodetachment photoelectron spectroscopy of the weakly bound OClO-center dot H2O complex,
Z. Phys. Chem., 2007, 221, 5, 609-618, https://doi.org/10.1524/zpch.2007.221.5.609
. [all data]
Magnera, David, et al., 1989
Magnera, T.F.; David, D.E.; Michl, J.,
Gas -Phase Water and Hydroxyl Binding Energies for Monopoisitive First - Row Transition - Metal Ions,
J. Am. Chem. Soc., 1989, 111, 11, 4101, https://doi.org/10.1021/ja00193a051
. [all data]
Marinelli and Squires, 1989
Marinelli, P.J.; Squires, R.R.,
Sequential Solvation of Atomic Transition Metal Ions: The Second Solvent Molecule Can Bind More Strongly than the First,
J. Am. Chem. Soc., 1989, 111, 11, 4101, https://doi.org/10.1021/ja00193a052
. [all data]
Armentrout and Kickel, 1994
Armentrout, P.B.; Kickel, B.L.,
Gas Phase Thermochemistry of Transition Metal Ligand Systems: Reassessment of Values and Periodic Trends, in Organometallic Ion Chemistry, B. S. Freiser, ed, 1994. [all data]
McKnight and Sawina, 1972
McKnight, L.G.; Sawina, J.M.,
Drift Velocities and Interactions of Cs+ Ions with Atmospheric Gases,
J. Chem. Phys., 1972, 57, 12, 5156, https://doi.org/10.1063/1.1678205
. [all data]
Dzidic and Kebarle, 1970
Dzidic, I.; Kebarle, P.,
Hydration of the Alkali Ions in the Gas Phase. Enthalpies and Entropies of Reactions M+(H2O)n-1 + H2O = M+(H2O)n,
J. Phys. Chem., 1970, 74, 7, 1466, https://doi.org/10.1021/j100702a013
. [all data]
El-Shall, Schriver, et al., 1989
El-Shall, M.S.; Schriver, K.E.; Whetten, R.L.; Meot-Ner (Mautner), M.,
Ion/Molecule Clustering Thermochemistry by Laser Ionization High - Pressure Mass Spectrometry,
J. Phys. Chem., 1989, 93, 24, 7969, https://doi.org/10.1021/j100361a002
. [all data]
Magnera, David, et al., 1989, 2
Magnera, T.F.; David, D.E.; Stulik, D.; Orth, R.G.; Jorikman, H.T.; Michl, J.,
Production of Hydrated Metal Ions by Fast Ion or Atom Beam Sputtering. Collision - Induced Dissociation and Successive Hydration Energies of Gaseous Cu+ with 1 - 4 Water Molecules,
J. Am. Chem. Soc., 1989, 111, 14, 5036, https://doi.org/10.1021/ja00196a003
. [all data]
Weis, Kemper, et al., 1999
Weis, P.; Kemper, P.R.; Bowers, M.T.; Xantheas, S.S.,
A new determination of the fluoride ion-water bond energy,
J. Am. Chem. Soc., 1999, 121, 14, 3531-3532, https://doi.org/10.1021/ja9842161
. [all data]
Miller, Leopold, et al., 1985
Miller, T.M.; Leopold, D.G.; Murray, K.K.; Lineberger, W.C.,
The Photoelectron Spectrum of H3O-,
Bull. Am. Phys. Soc., 1985, 30, 880. [all data]
Paulson and Henchman, 1984
Paulson, J.F.; Henchman, M.J.,
On the Formation of H3O- in an Ion-Molecule Reaction
in Ionic Processes in the Gas Phase,, M.A. Almoster Ferreira, Ed., Reidel, Dordrecht,, 1984, 331. [all data]
Griffiths and Harris, 1989
Griffiths, W.J.; Harris, F.M.,
Amended Interpretation of the Results Obtained in an Experimental Investigation of the Structure of the H3O- Ion,
Int. J. Mass Spectrom. Ion Proc., 1989, 87, 1, R25, https://doi.org/10.1016/0168-1176(89)80017-5
. [all data]
Paulson and Henchman, 1982
Paulson, J.F.; Henchman, M.J.,
The Hydrated Negative Hydrogen Ion,
Bull. Am. Phys. Soc., 1982, 27, 108. [all data]
Paul and Kebarle, 1990
Paul, G.J.C.; Kebarle, P.,
Thermodynamics of the Association Reactions OH- - H2O = HOHOH- and CH3O- - CH3OH = CH3OHOCH3- in the Gas Phase,
J. Phys. Chem., 1990, 94, 12, 5184, https://doi.org/10.1021/j100375a076
. [all data]
Meot-Ner (Mautner) and Speller, 1986
Meot-Ner (Mautner), M.; Speller, C.V.,
The Filling of Solvent Shells in Cluster Ions: Thermochemical Criteria nd the Effects of Isomeric Clusters,
J. Phys. Chem., 1986, 90, 25, 6616, https://doi.org/10.1021/j100283a006
. [all data]
Arshadi and Kebarle, 1970
Arshadi, M.; Kebarle, P.,
Hydration of OH- and O2- in the Gas Phase. Comparative Solvation of OH- by Water and the Hydrogen Halides. Effect of Acidity,
J. Phys. Chem., 1970, 74, 7, 1483, https://doi.org/10.1021/j100702a015
. [all data]
Hierl and Paulson, 1984
Hierl, P.M.; Paulson, J.F.,
Translational energy dependence of cross sections for reactions of OH- (H2O)n with CO2 and SO2,
J. Chem. Phys., 1984, 80, 4890. [all data]
DePaz, Giardini, et al., 1970
DePaz, M.; Giardini, A.G.; Friedman, L.,
Tandem-Mass-Spectrometer Study of Solvated Derivatives of OD-. Total Hydration Energy of the Proton,
J. Chem. Phys., 1970, 52, 2, 687, https://doi.org/10.1063/1.1673041
. [all data]
Arnold, Viggiano, et al., 1982
Arnold, F.; Viggiano, A.A.; Schlager, H.,
Implications for Trace Gases and Aerosols of Large Negative Ions Clusters in the Stratosphere,
Nature, 1982, 297, 5865, 371, https://doi.org/10.1038/297371a0
. [all data]
Yang, Kiran, et al., 2004
Yang, X.; Kiran, B.; Wang, X.B.; Wang, L.S.; Mucha, M.; Jungwirth, P.,
Solvation of the azide anion (N-3(-)) in water clusters and aqueous interfaces: A combined investigation by photoelectron spectroscopy, density functional calculations, and molecular dynamic,
J. Phys. Chem. A, 2004, 108, 39, 7820-7826, https://doi.org/10.1021/jp0496396
. [all data]
Ng, Trevor, et al., 1977
Ng, C.Y.; Trevor, D.J.; Tiedemann, P.W.; Ceyer, S.T.; Kronebush, B.H.; Mahan, B.H.; Lee, Y.T.,
Photoinization of Dimeric Polyatomic Molecules: Proton Affinities of H2O and HF,
J. Chem. Phys., 1977, 67, 9, 4235, https://doi.org/10.1063/1.435404
. [all data]
Clements, Luong, et al., 2001
Clements, T.G.; Luong, A.K.; Deyerl, H.J.; Continetti, R.E.,
Dissociative photodetachment studies of O-(H2O)(2), OH- (H2O)(2), and the deuterated isotopomers: Energetics and three- body dissociation dynamics,
J. Chem. Phys., 2001, 114, 19, 8436-8444, https://doi.org/10.1063/1.1366332
. [all data]
Le Barbu, Schiedt, et al., 2002
Le Barbu, K.; Schiedt, J.; Weinkauf, R.; Schlag, E.W.; Nilles, J.M.; Xu, S.J.; Thomas, O.C.; Bowen, K.H.,
Microsolvation of small anions by aromatic molecules: An exploratory study,
J. Chem. Phys., 2002, 116, 22, 9663-9671, https://doi.org/10.1063/1.1475750
. [all data]
Blades, Ho, et al., 1996, 2
Blades, A.T.; Ho, Y.; Kebarle, P.,
Hydration in the Gas Phase of the Orthophosphate Anion, (HO)2PO2-, and the Conversion of the Orthophosphate to teh Metaphosphate, PO3-, Ion,
J. Am. Chem. Soc., 1996, 118, 1, 196, https://doi.org/10.1021/ja952169w
. [all data]
Arifov, Pozharov, et al., 1971
Arifov, U.A.; Pozharov, S.L.; Chernov, I.G.,
High Energy Chem., 1971, 5, 1. [all data]
Bierbaum, Golde, et al., 1976
Bierbaum, V.M.; Golde, M.F.; Kaufman, F.,
Flowing Afterglow Studies of Hydronium Ion Clustering Including Diffusion Effects,
J. Chem. Phys., 1976, 65, 7, 2715, https://doi.org/10.1063/1.433415
. [all data]
Puckett and Teague, 1971
Puckett, L.J.; Teague, A.W.,
Production of H3O+.nH2O from NO+ Precursor in NO - H2O Gas Mixtures,
J. Chem. Phys., 1971, 54, 6, 2564, https://doi.org/10.1063/1.1675213
. [all data]
Good, Durden, et al., 1970
Good, A.; Durden, D.A.; Kebarle, P.,
Ion-Molecule Reactions in Pure Nitrogen and Nitrogen Containing Traces of Water at Total Pressures 0.5 - 4 torr. Kinetics of Clustering Reactions Forming H+(H2O)n,
J. Chem. Phys., 1970, 52, 1, 212, https://doi.org/10.1063/1.1672667
. [all data]
Good, Durden, et al., 1970, 2
Good, A.; Durden, D.A.; Kebarle, P.,
Mechanism and Rate Constants of Ion-Molecule Reactions Leading to Formation of H+(H2O)n in Moist Oxygen and Air,
J. Chem. Phys., 1970, 52, 1, 222, https://doi.org/10.1063/1.1672668
. [all data]
Lau, Ikuta, et al., 1982
Lau, Y.K.; Ikuta, S.; Kebarle, P.,
Thermodynamics and Kinetics of the Gas - Phase Reactions: H3O+(H2O)n - 1 + H2O = H3O+(H2O)n,
J. Am. Chem. Soc., 1982, 104, 6, 1462, https://doi.org/10.1021/ja00370a002
. [all data]
Kebarle, Searles, et al., 1967
Kebarle, P.; Searles, S.K.; Zolla, A.; Scarborough, J.; Arshadi, M.,
The Solvation of the Hydrogen Ion by Water Molecules in the Gas Phase. Heats and Entropies of Solvation of the Individual Reactions: H+(H2O)n-1 + H2O = H+(H2O)n,
J. Am. Chem. Soc., 1967, 89, 25, 6393, https://doi.org/10.1021/ja01001a001
. [all data]
Shi, Ford, et al., 1993
Shi, Z.; Ford, V.; Wei, S.; Castleman, A.W.,
Water Clusters - Contributions of Binding Energy and Entropy to Stability,
J. Chem. Phys., 1993, 99, 10, 8009, https://doi.org/10.1063/1.465678
. [all data]
Magnera, David, et al., 1991
Magnera, T.F.; David, D.E.; Michl, J.,
The First Twenty - Eight Proton Hydration Energies,
Chem. Phys. Lett., 1991, 182, 3-4, 363, https://doi.org/10.1016/0009-2614(91)80230-U
. [all data]
Walters and Blais, 1984
Walters, E.A.; Blais, N.C.,
Molecular beam photoionization and fragmentation of D2S, (H2S)2, (D2S)2, and H2S.H2O,
J. Chem. Phys., 1984, 80, 3501. [all data]
Payzant, Cunningham, et al., 1973
Payzant, J.D.; Cunningham, A.J.; Kebarle, P.,
Gas - Phase Solvation of Ammonium Ion by NH3 and H2O and Stabilities of Mixed Clusters NH4+(NH3)n(H2O)w,
Can. J. Chem., 1973, 51, 19, 3242, https://doi.org/10.1139/v73-485
. [all data]
Blades, Ho, et al., 1996, 3
Blades, A.T.; Ho, Y.; Kebarle, P.,
Hydration in the Gas Phase of the Orthophosphate Anion (HO)2PO2-, and the Conversion of the Orthophosphate anion to the Metaphosphate, PO3-, Ion,
J. Am. Chem. Soc., 1996, 118, 1, 196, https://doi.org/10.1021/ja952169w
. [all data]
Meot-Ner, 1984, 2
Meot-Ner, (Mautner)M.,
The Ionic Hydrogen Bond and Ion Solvation. 1. -NH+ O-, -NH+ N- and -OH+ O- Bonds. Correlations with Proton Affinity. Deviations Due to Structural Effects,
J. Am. Chem. Soc., 1984, 106, 5, 1257, https://doi.org/10.1021/ja00317a015
. [all data]
Blades and Kebarle, 2005
Blades, A.T.; Kebarle, P.,
Sequential hydration energies of the sulfate ion, from determinations of the equilibrium constants for the gas-phase reactions: SO4(H2O)(n)(2-) = SO4(H2O)(n-1)(2-)+H2O,
J. Phys. Chem. A, 2005, 109, 37, 8293-8298, https://doi.org/10.1021/jp0540353
. [all data]
Sunner, Nishizawa, et al., 1981
Sunner, J.; Nishizawa, K.; Kebarle, P.,
Ion - Solvent Molecule Interactions in the Gas Phase. Potassium Ion and Benzene,
J. Phys. Chem., 1981, 85, 13, 1814, https://doi.org/10.1021/j150613a011
. [all data]
Searles and Kebarle, 1969
Searles, S.K.; Kebarle, P.,
Hydration of the Potassium Ion in the Gas Phase: Enthalpies and Entropies of Hydration Reactions K+(H2O)n-1 + H2O = K+(H2O)n for n=1 to n=6,
Can. J. Chem., 1969, 47, 14, 2619, https://doi.org/10.1139/v69-432
. [all data]
Davidson and Kebarle, 1976
Davidson, W.R.; Kebarle, P.,
Ionic Solvation by Aprotic Solvents. Gas Phase Solvation of the Alkali Ions by Acetonitrile,
J. Am. Chem. Soc., 1976, 98, 20, 6125, https://doi.org/10.1021/ja00436a010
. [all data]
Chupka, 1959
Chupka, W.A.,
Dissociation Energies of Some Gaseous Halide Complex Ions and the Hydrated Ion K(H2O)+,
J. Chem. Phys., 1959, 40, 2, 458, https://doi.org/10.1063/1.1729974
. [all data]
Rodgers and Armentrout, 2000
Rodgers, M.T.; Armentrout, P.B.,
Noncovalent Metal-Ligand Bond Energies as Studied by Threshold Collision-Induced Dissociation,
Mass Spectrom. Rev., 2000, 19, 4, 215, https://doi.org/10.1002/1098-2787(200007)19:4<215::AID-MAS2>3.0.CO;2-X
. [all data]
Andersen, Muntean, et al., 2000
Andersen, A.; Muntean, F.; Walter, D.; Rue, C.; Armentrout, P.B.,
Collision-Induced Dissociation and Theoretical Studies of Mg+ Complexes with CO, CO2, NH3, CH4, CH3OH, and C6H6,
J. Phys. Chem. A, 2000, 104, 4, 692, https://doi.org/10.1021/jp993031t
. [all data]
French, Hills, et al., 1973
French, M.A.; Hills, L.P.; Kebarle, P.,
Kinetics and Temperature Dependence of the Hydration of the Nitrosonium Ion in the Gas Phase,
Can. J. Chem., 1973, 51, 3, 456, https://doi.org/10.1139/v73-068
. [all data]
Eaton, Arnold, et al., 1990
Eaton, J.G.; Arnold, S.T.; Bowen, K.H.,
The Negative Ion Photoelectron (Photodetachment) Spectra of NO-(H2O)n=1,2,
Int. J. Mass Spectrom. Ion Proc., 1990, 102, 303, https://doi.org/10.1016/0168-1176(90)80066-C
. [all data]
McAdams and Bone, 1972
McAdams, M.J.; Bone, L.I.,
Reactions of NO+ with H2O in a Photoionization Mass Spectrometer,
J. Chem. Phys., 1972, 57, 5, 2173, https://doi.org/10.1063/1.1678549
. [all data]
Howard, Rundle, et al., 1971
Howard, C.J.; Rundle, H.W.; Kaufman, F.,
Water Cluster Formation Rates of NO+ in He, Ar, N2, and O2 at 296 K,
J. Chem. Phys., 1971, 55, 10, 4772, https://doi.org/10.1063/1.1675576
. [all data]
Graul, Kim, et al., 1992
Graul, S.T.; Kim, H.S.; Bowers, M.T.,
The Dynamics of Photodissociation of the Gas Phase (N2O.H2O)+ Cluster Ion,
Int. J. Mass Spectrom. Ion Proc., 1992, 117, 507, https://doi.org/10.1016/0168-1176(92)80111-D
. [all data]
Bohringer, Fahey, et al., 1984
Bohringer, H.; Fahey, D.W.; Fehsenfeld, F.C.; Ferguson, E.E.,
Bond energies of the molecules H2O, SO2, H2O2, and HCl to various atmospheric negative ions,
J. Chem. Phys., 1984, 81, 2805. [all data]
Lee, Keesee, et al., 1980
Lee, N.; Keesee, R.G.; Castleman, A.W., Jr.,
The properties of clusters in the gas phase. IV. Complexes of H2O and HNOx clustering on NOx-,
J. Chem. Phys., 1980, 72, 1089. [all data]
Paulson and Dale, 1982
Paulson, J.F.; Dale, J.,
Reactions of OH-.H2O with NO2,
J. Chem. Phys., 1982, 77, 4006. [all data]
Payzant, Cunningham, et al., 1972
Payzant, J.D.; Cunningham, A.J.; Kebarle, P.,
Kinetics and Rate Constants of Reactions Leading to Hydration of NO2- and NO3- in Gaseous Oxygen, Argon, and Helium Containing Traces of Water,
Can. J. Chem., 1972, 50, 14, 2230, https://doi.org/10.1139/v72-358
. [all data]
Arnold and Qiu, 1984
Arnold, F.; Qiu, S.,
Upper Stratosphere Negative Ion Composition Measurements and Infrared Trace Gas Abundances,
Planet. Space Sci., 1984, 32, 2, 169, https://doi.org/10.1016/0032-0633(84)90151-X
. [all data]
Peterson, Mark, et al., 1984
Peterson, K.I.; Mark, T.D.; Keesee, R.G.; Castleman, A.W.,
Thermochemical Properties of Gas - Phase Mixed Clusters: H2O/CO2 with Na+,
J. Phys. Chem., 1984, 88, 13, 2880, https://doi.org/10.1021/j150657a042
. [all data]
Perry, Rowe, et al., 1980
Perry, R.A.; Rowe, B.R.; Viggiano, A.A.; Albritton, D.L.; Ferguson, E.E.; Fehsenfeld, F.C.,
Laboratory Measurements of Stratospheric Sodium Ion Measurements,
Geophys. Res. Lett., 1980, 7, 9, 693, https://doi.org/10.1029/GL007i009p00693
. [all data]
Amicangelo and Armentrout, 2001
Amicangelo, J.C.; Armentrout, P.B.,
Relative and Absolute Bond Dissociation Energies of Sodium Cation Complexes Determined Using Competitive Collision-Induced Dissociation Experiments,
Int. J. Mass Spectrom., 2001, 212, 1-3, 301, https://doi.org/10.1016/S1387-3806(01)00494-8
. [all data]
McMahon and Ohanessian, 2000
McMahon, T.B.; Ohanessian, G.,
An Experimental and Ab Initio Study of the Nature of the Binding in Gas-Phase Complexes of Sodium Ions,
Chem. Eur. J., 2000, 6, 16, 2931, https://doi.org/10.1002/1521-3765(20000818)6:16<2931::AID-CHEM2931>3.0.CO;2-7
. [all data]
Tang, Lian, et al., 1976
Tang, I.N.; Lian, M.S.; Castleman, A.W.,
Mass Spectrometric Study of Gas - Phase Clustering Reactions: Hydration of the Monovalent Strontium Ion,
J. Chem. Phys., 1976, 65, 10, 4022, https://doi.org/10.1063/1.432854
. [all data]
Tang and Castleman, 1972
Tang, I.N.; Castleman, A.W.,
Mass Spectrometric Study of the Gas - Phase Hydration of the Monovalent Lead Ion,
J. Chem. Phys., 1972, 57, 9, 3638, https://doi.org/10.1063/1.1678820
. [all data]
Blades, Jayaweera, et al., 1990, 2
Blades, A.T.; Jayaweera, P.; Ikonomou, M.G.; Kebarle, P.,
Ion - Molecule Clusters Involving Doubly Charged Metal - Ions (M2+),
Int. J. Mass Spectrom. Ion Proc., 1990, 102, 251, https://doi.org/10.1016/0168-1176(90)80064-A
. [all data]
Deyerl, Clements, et al., 2001
Deyerl, H.J.; Clements, T.G.; Luong, A.K.; Continetti, R.E.,
Transition state dynamics of the OH+OH - O+H2O reaction studied by dissociative photodetachment of H2O2-,
J. Chem. Phys., 2001, 115, 15, 6931-6940, https://doi.org/10.1063/1.1404148
. [all data]
Arnold, Xu, et al., 1995
Arnold, D.W.; Xu, C.S.; Neumark, D.M.,
Spectroscopy of the transition state: Elementary reactions of the hydroxyl radical studied by photoelectron spectroscopy of O-(H2O) and H3O2,
J. Chem. Phys., 1995, 102, 15, 6088, https://doi.org/10.1063/1.469343
. [all data]
Roehl, Snodgrass, et al., 1991
Roehl, C.M.; Snodgrass, J.T.; Deakyne, C.A.; Bowers, M.T.,
Photodissociation of CO3-.H2O: Observation of the O-.H2O + CO2 Product Channel,
J. Chem. Phys., 1991, 94, 10, 6546, https://doi.org/10.1063/1.460281
. [all data]
Adams and Bohme, 1970
Adams, N.G.; Bohme, D.,
Flowing Afterglow Studies of Formation and Reactions of Cluster Ions of O2+, O2-, and O-,
J. Chem. Phys., 1970, 52, 6, 3133, https://doi.org/10.1063/1.1673449
. [all data]
Luong, Clements, et al., 2001
Luong, A.K.; Clements, T.G.; Resat, M.S.; Continetti, R.E.,
Energetics and dissociative photodetachment dynamics of superoxide-water clusters: O-2(-)(H2O)(n), n=1-6,
J. Chem. Phys., 2001, 114, 8, 3449-3455, https://doi.org/10.1063/1.1342221
. [all data]
Parkes, 1971
Parkes, D.A.,
Electron Attachment and Negative Ion-Molecule Reactions in Pure O2,
Trans. Farad. Soc., 1971, 97, 711, https://doi.org/10.1039/tf9716700711
. [all data]
Payzant J.D. and Kebarle, 1972
Payzant J.D.; Kebarle, P.,
Kinetics and Reactions Leading to O2-(H2O)n in Moist Oxygen,
J. Chem. Phys., 1972, 56, 7, 3482, https://doi.org/10.1063/1.1677723
. [all data]
Pack and Phelps, 1971
Pack, J.L.; Phelps, A.V.,
Hydration of Oxygen Negative Ions,
Bull. Am. Phys. Soc., 1971, 16, 214. [all data]
Vacher, Leduc, et al., 1994
Vacher, J.R.; Leduc, E.; Fitaire, M.,
Stabilities of Anionic Mixed Clusters of Sulfur Dioxide and Water,
Int. J. Mass Spectrom. Ion Proc., 1994, 135, 2-3, 139, https://doi.org/10.1016/0168-1176(94)03985-2
. [all data]
Keesee and Castleman Jr., 1989
Keesee, R.G.; Castleman Jr.,
Hydration of Monomeric Metaphosphate Anion in the Gas Phase,
J. Am. Chem. Soc., 1989, 111, 25, 9015, https://doi.org/10.1021/ja00207a004
. [all data]
Möhler, Reiner, et al., 1992
Möhler, O.; Reiner, T.; Arnold, F.,
The Formation of SO5(-) by Gas Phase Ion-Molecule Reactions,
J. Chem. Phys., 1992, 97, 11, 8233, https://doi.org/10.1063/1.463394
. [all data]
Shimanouchi, 1972
Shimanouchi, T.,
Tables of Molecular Vibrational Frequencies Consolidated Volume I, National Bureau of Standards, 1972, 1-160. [all data]
Landault and Guiochon, 1964
Landault, C.; Guiochon, G.,
Separation des amines par chromatographie gaz-liquide en utilisant le teflon comme support,
J. Chromatogr., 1964, 13, 327-336, https://doi.org/10.1016/S0021-9673(01)95126-X
. [all data]
Zenkevich, 2005
Zenkevich, I.G.,
Experimentally measured retention indices., 2005. [all data]
Zenkevich, Korolenko, et al., 1995
Zenkevich, I.G.; Korolenko, L.I.; Khralenkova, N.B.,
Desorption with solvent vapor as a method of sample preparation in the sorption preconcentration of organic-compounds from the air of a working area and from industrial-waste gases,
J. Appl. Chem. USSR (Engl. Transl.), 1995, 50, 10, 937-944. [all data]
Peng, Yang, et al., 1991
Peng, C.T.; Yang, Z.C.; Ding, S.F.,
Prediction of rentention idexes. II. Structure-retention index relationship on polar columns,
J. Chromatogr., 1991, 586, 1, 85-112, https://doi.org/10.1016/0021-9673(91)80028-F
. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Vibrational and/or electronic energy levels, Gas Chromatography, References
- Symbols used in this document:
AE Appearance energy IE (evaluated) Recommended ionization energy Pc Critical pressure Ptriple Triple point pressure S°gas,1 bar Entropy of gas at standard conditions (1 bar) T Temperature Tboil Boiling point Tc Critical temperature ΔfH°gas Enthalpy of formation of gas at standard conditions ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions ΔrS° Entropy of reaction at standard conditions ρc Critical density - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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