Carbon monoxide
- Formula: CO
- Molecular weight: 28.0101
- IUPAC Standard InChIKey: UGFAIRIUMAVXCW-UHFFFAOYSA-N
- CAS Registry Number: 630-08-0
- 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. - Other names: Carbon oxide (CO); CO; Exhaust gas; Flue gas; Carbonic oxide; Carbon oxide; Carbone (oxyde de); Carbonio (ossido di); Kohlenmonoxid; Kohlenoxyd; Koolmonoxyde; NA 9202; Oxyde de carbone; UN 1016; Wegla tlenek; Carbon monooxide
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Gas phase thermochemistry data
Go To: Top, Phase change data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, 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 | -26.417 ± 0.041 | kcal/mol | Review | Cox, Wagman, et al., 1984 | CODATA Review value |
ΔfH°gas | -26.417 | kcal/mol | Review | Chase, 1998 | Data last reviewed in September, 1965 |
Quantity | Value | Units | Method | Reference | Comment |
S°gas,1 bar | 47.2419 ± 0.001 | cal/mol*K | Review | Cox, Wagman, et al., 1984 | CODATA Review value |
S°gas,1 bar | 47.242 | cal/mol*K | Review | Chase, 1998 | Data last reviewed in September, 1965 |
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 (cal/mol*K)
H° = standard enthalpy (kcal/mol)
S° = standard entropy (cal/mol*K)
t = temperature (K) / 1000.
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Temperature (K) | 298. to 1300. | 1300. to 6000. |
---|---|---|
A | 6.110801 | 8.401219 |
B | 1.457011 | 0.310730 |
C | 0.969086 | -0.049216 |
D | -0.638456 | 0.003239 |
E | 0.031315 | -0.784603 |
F | -28.20480 | -30.55390 |
G | 54.34190 | 55.38050 |
H | -26.41661 | -26.41661 |
Reference | Chase, 1998 | Chase, 1998 |
Comment | Data last reviewed in September, 1965 | Data last reviewed in September, 1965 |
Phase change data
Go To: Top, Gas phase thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, 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
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 81.63 | K | N/A | Mullins, Kirk, et al., 1963 | Uncertainty assigned by TRC = 0.05 K; TRC |
Tboil | 81.61 | K | N/A | Clayton and Giauque, 1932 | Uncertainty assigned by TRC = 0.07 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 67.95 | K | N/A | Gill and Morrison, 1966 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.06 K; TRC |
Ttriple | 68.12 | K | N/A | Mullins, Kirk, et al., 1963 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.05 K; TRC |
Ttriple | 68.09 | K | N/A | Clayton and Giauque, 1932 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.07 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 134.45 | K | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.4 K; 4 determinations with same result; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 34.5300 | atm | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.2999 atm; TRC |
Pc | 34.5300 | atm | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.2999 atm; TRC |
Pc | 34.6900 | atm | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.2999 atm; TRC |
Pc | 34.7500 | atm | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.2999 atm; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ρc | 11.1 | mol/l | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.04 mol/l; extrapolation of rectilinear diameter to Tc; TRC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
1.4 | 93. | A | Stephenson and Malanowski, 1987 | Based on data from 68. to 108. K.; AC |
1.4 | 81. | N/A | Clayton and Giauque, 1932, 2 | Based on data from 69. to 83. K.; AC |
1.4 | 81. | C | Clayton and Giauque, 1932, 2 | AC |
Enthalpy of sublimation
ΔsubH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
1.8 | 58. | N/A | Stephenson and Malanowski, 1987 | Based on data from 54. to 61. K.; AC |
1.9 | 60. | A | Stull, 1947 | Based on data from 51. to 68. K.; AC |
1.9 | 62. | A | Crommelin, Bijleveld, et al., 1931 | Based on data from 57. to 68. K.; AC |
Henry's Law data
Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, Ion clustering data, 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: Rolf Sander
Henry's Law constant (water solution)
kH(T) = k°H exp(d(ln(kH))/d(1/T) ((1/T) - 1/(298.15 K)))
k°H = Henry's law constant for solubility in water at 298.15 K (mol/(kg*bar))
d(ln(kH))/d(1/T) = Temperature dependence constant (K)
k°H (mol/(kg*bar)) | d(ln(kH))/d(1/T) (K) | Method | Reference | Comment |
---|---|---|---|---|
0.00099 | 1300. | L | N/A | |
0.00095 | 1600. | Q | N/A | Only the tabulated data between T = 273. K and T = 303. K from missing citation was used to derive kH and -Δ kH/R. Above T = 303. K the tabulated data could not be parameterized by equation (reference missing) very well. The partial pressure of water vapor (needed to convert some Henry's law constants) was calculated using the formula given by missing citation. The quantities A and α from missing citation were assumed to be identical. |
0.00086 | Q | N/A | missing citation give several references for the Henry's law constants but don't assign them to specific species. | |
0.00095 | 1300. | L | N/A | |
0.00082 | c | N/A | ||
0.0074 | M | N/A |
Gas phase ion energetics data
Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law data, Ion clustering data, 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:
LL - Sharon G. Lias and Joel F. Liebman
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
B - John E. Bartmess
View reactions leading to CO+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
IE (evaluated) | 14.014 ± 0.0003 | eV | N/A | N/A | L |
Quantity | Value | Units | Method | Reference | Comment |
Proton affinity (review) | 142. | kcal/mol | N/A | Hunter and Lias, 1998 | at C; HL |
Proton affinity (review) | 101.9 | kcal/mol | N/A | Hunter and Lias, 1998 | at O; HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 134.5 | kcal/mol | N/A | Hunter and Lias, 1998 | at C; HL |
Gas basicity | 96.13 | kcal/mol | N/A | Hunter and Lias, 1998 | at O; HL |
Quantity | Value | Units | Method | Reference | Comment |
ΔfH°(+) ion | 296.7 | kcal/mol | N/A | N/A | |
Quantity | Value | Units | Method | Reference | Comment |
ΔfH(+) ion,0K | 296.0 | kcal/mol | N/A | N/A |
Electron affinity determinations
EA (eV) | Method | Reference | Comment |
---|---|---|---|
1.32608 | R-A | Refaey and Franklin, 1976 | G3MP2B3 calculations indicate an EA of ca.-1.6 eV, anion unbound; B |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
14.0142 ± 0.0003 | LS | Erman, Karawajczyk, et al., 1993 | LL |
14.1 | PE | Kimura, Katsumata, et al., 1981 | LLK |
14.014 | S | Fock, Gurtler, et al., 1980 | LLK |
14.07 ± 0.05 | EI | Hille and Mark, 1978 | LLK |
14.0 | PI | Rabalais, Debies, et al., 1974 | LLK |
14.01 | PE | Natalis, 1973 | LLK |
14.0139 | S | Ogawa and Ogawa, 1972 | LLK |
14.01 | PE | Hotop and Niehaus, 1970 | RDSH |
14.01 | PE | Collin and Natalis, 1969 | RDSH |
14.00 | PE | Turner and May, 1966 | RDSH |
14.013 ± 0.004 | S | Krupenie, 1966 | RDSH |
13.985 | PI | Cook, Metzger, et al., 1965 | RDSH |
14.01 | PE | Potts and Williams, 1974 | Vertical value; LLK |
14.01 | PE | Katrib, Debies, et al., 1973 | Vertical value; LLK |
14.0 | PE | Thomas, 1970 | Vertical value; RDSH |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
C+ | 20.94 ± 0.02 | O- | PI | Oertel, Schenk, et al., 1980 | LLK |
C+ | 20.89 | O-(2P) | EI | Smyth, Schiavone, et al., 1974 | LLK |
C+ | 20.88 ± 0.02 | O- | EI | Locht and Momigny, 1971 | LLK |
C+ | 22.45 ± 0.10 | O | EI | Hierl and Franklin, 1967 | RDSH |
C+ | 20.82 ± 0.05 | O- | EI | Hierl and Franklin, 1967 | RDSH |
C+ | 22.57 ± 0.20 | O | EI | Fineman and Petrocelli, 1961 | RDSH |
C+ | 20.89 ± 0.09 | O- | EI | Fineman and Petrocelli, 1961 | RDSH |
CO+ | 19.5 ± 0.2 | O-? | PI | Weissler, Samson, et al., 1959 | RDSH |
O+ | 23.44 | C- | EI | Smyth, Schiavone, et al., 1974 | LLK |
O+ | 23.20 ± 0.05 | C- | EI | Hierl and Franklin, 1967 | RDSH |
O+ | 24.65 ± 0.05 | C | EI | Hierl and Franklin, 1967 | RDSH |
O+ | 23.41 ± 0.17 | C- | EI | Fineman and Petrocelli, 1961 | RDSH |
O+ | 24.78 ± 0.23 | C | EI | Fineman and Petrocelli, 1961 | RDSH |
Ion clustering data
Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law data, Gas phase ion energetics data, 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+ + CO = (Ag+ • CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21.2 (+1.2,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Ag+ • CO) + CO = (Ag+ • 2CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
26.1 (+0.9,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Ag+ • 2CO) + CO = (Ag+ • 3CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
13.1 (+1.8,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Ag+ • 3CO) + CO = (Ag+ • 4CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
10.8 (+0.9,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: Ar+ + CO = (Ar+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 18. ± 4. | kcal/mol | PIPECO | Norwood, Guo, et al., 1989 | gas phase; Ar+(2P3/2); M |
By formula: (Ar+ • CO) + CO = (Ar+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3. | kcal/mol | PIPECO | Norwood, Guo, et al., 1989 | gas phase; approximate value from Ar+(2P3/2) 2CO -> Ar+(2P3/2) + 2CO; M |
By formula: CF3+ + CO = (CF3+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 16.0 | kcal/mol | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 30. | cal/mol*K | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
By formula: (CF3+ • CO) + CO = (CF3+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.3 | kcal/mol | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 20. | cal/mol*K | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
By formula: (CF3+ • 2CO) + CO = (CF3+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.8 | kcal/mol | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 26. | cal/mol*K | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
By formula: (CF3+ • 3CO) + CO = (CF3+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.4 | kcal/mol | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 28. | cal/mol*K | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
By formula: (CF3+ • 4CO) + CO = (CF3+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3.2 | kcal/mol | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 26. | cal/mol*K | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
By formula: (CF3+ • 5CO) + CO = (CF3+ • 6CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.9 | kcal/mol | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 28. | cal/mol*K | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
By formula: (CF3+ • 6CO) + CO = (CF3+ • 7CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.6 | kcal/mol | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 28. | cal/mol*K | PHPMS | Hiraoka, Nasu, et al., 1996 | gas phase; M |
(CFeO- • 4294967295) + = CFeO-
By formula: (CFeO- • 4294967295CO) + CO = CFeO-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 34.8 ± 3.5 | kcal/mol | N/A | Villalta and Leopold, 1993 | gas phase; B |
ΔrH° | 33.7 ± 3.5 | kcal/mol | CIDT | Sunderlin, Wang, et al., 1992 | gas phase; B |
By formula: CHO+ + CO = (CHO+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10.8 | kcal/mol | PHPMS | Jennings, Headley, et al., 1982 | gas phase; M |
ΔrH° | 12.8 | kcal/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
ΔrH° | 11.7 | kcal/mol | PHPMS | Meot-Ner (Mautner) and Field, 1974 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22.5 | cal/mol*K | PHPMS | Jennings, Headley, et al., 1982 | gas phase; M |
ΔrS° | 24. | cal/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
ΔrS° | 20.9 | cal/mol*K | PHPMS | Meot-Ner (Mautner) and Field, 1974 | gas phase; M |
By formula: (CHO+ • CO) + CO = (CHO+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.9 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrH° | 6.6 | kcal/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 15.0 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrS° | 24. | cal/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
By formula: (CHO+ • 2CO) + CO = (CHO+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.7 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrH° | 6.3 | kcal/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 15.8 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrS° | 26. | cal/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
By formula: (CHO+ • 3CO) + CO = (CHO+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.5 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrH° | 6.2 | kcal/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 18.2 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrS° | 29. | cal/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
By formula: (CHO+ • 4CO) + CO = (CHO+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.2 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrH° | 5.8 | kcal/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22.9 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrS° | 32. | cal/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
By formula: (CHO+ • 5CO) + CO = (CHO+ • 6CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.4 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 19.0 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 6CO) + CO = (CHO+ • 7CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.3 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 21.1 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 7CO) + CO = (CHO+ • 8CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.2 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22.0 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 8CO) + CO = (CHO+ • 9CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.1 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22.6 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 9CO) + CO = (CHO+ • 10CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.0 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22.3 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 10CO) + CO = (CHO+ • 11CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.0 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 23.0 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 11CO) + CO = (CHO+ • 12CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.9 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 23.2 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 12CO) + CO = (CHO+ • 13CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.8 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 23.2 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 13CO) + CO = (CHO+ • 14CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.8 ± 0.3 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 23.1 | cal/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (CHO+ • 14CO) + CO = (CHO+ • 15CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.76 | kcal/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 23. | cal/mol*K | N/A | Hiraoka and Mori, 1989 | gas phase; Entropy change calculated or estimated; M |
By formula: (CHO- • 4294967295CO) + CO = CHO-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.42 ± 0.45 | kcal/mol | N/A | Murray, Miller, et al., 1986 | gas phase; B |
(CNiO- • 4294967295) + = CNiO-
By formula: (CNiO- • 4294967295CO) + CO = CNiO-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 33.0 ± 5.8 | kcal/mol | N/A | Stevens, Feigerle, et al., 1982 | gas phase; B |
ΔrH° | 32.4 ± 5.8 | kcal/mol | CIDT | Sunderlin, Wang, et al., 1992 | gas phase; Affinity: CO..Ni-; B |
By formula: CO+ + CO = (CO+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 16. | kcal/mol | PIPECO | Norwood, Guo, et al., 1988 | gas phase; CO+ in state B, ΔrH>; M |
ΔrH° | 22.4 | kcal/mol | PI | Linn, Ono, et al., 1981 | gas phase; M |
ΔrH° | 28. ± 7. | kcal/mol | EI | Munson and Franlin, 1962 | gas phase; from IP'switching reaction and heats of formation; M |
ΔrH° | 25.4 | kcal/mol | PHPMS | Meot-Ner (Mautner) and Field, 1974 | gas phase; ΔrH>, DG>; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 20. | cal/mol*K | PHPMS | Meot-Ner (Mautner) and Field, 1974 | gas phase; ΔrH>, DG>; M |
Free energy of reaction
ΔrG° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
4.9 | 340. | HPMS | Chong and Franklin, 1971 | gas phase; equilibrium uncertain; M |
11.5 | 695. | PHPMS | Meot-Ner (Mautner) and Field, 1974 | gas phase; ΔrH>, DG>; M |
By formula: (CO+ • CO) + CO = (CO+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.5 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
ΔrH° | 3.7 | kcal/mol | PI | Linn, Ono, et al., 1981 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 35.5 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: (CO+ • 2CO) + CO = (CO+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.21 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers, at low and high temperatures; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 24.5 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers, at low and high temperatures; M |
By formula: (CO+ • 3CO) + CO = (CO+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.40 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 20.5 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers; M |
By formula: (CO+ • 4CO) + CO = (CO+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.25 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 24.4 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers; M |
By formula: (CO+ • 5CO) + CO = (CO+ • 6CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.70 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers, at low and high temperatures; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 19.1 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; two isomers, at low and high temperatures; M |
By formula: (CO+ • 6CO) + CO = (CO+ • 7CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.25 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; break in the van't Hoff plot; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 21.1 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; break in the van't Hoff plot; M |
By formula: (CO+ • 7CO) + CO = (CO+ • 8CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.58 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; break in the van't Hoff plot; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 12.4 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; break in the van't Hoff plot; M |
By formula: (CO+ • 9CO) + CO = (CO+ • 10CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.85 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 19.1 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: (CO+ • 11CO) + CO = (CO+ • 12CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.13 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 27.1 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: (CO+ • 12CO) + CO = (CO+ • 13CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.10 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 27.7 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: (CO+ • 13CO) + CO = (CO+ • 14CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.08 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 28.6 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: (CO+ • 14CO) + CO = (CO+ • 15CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.92 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 26.8 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: (CO+ • 15CO) + CO = (CO+ • 16CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.92 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 27.6 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: (CO+ • 16CO) + CO = (CO+ • 17CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.88 | kcal/mol | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 27.6 | cal/mol*K | PHPMS | Hiraoka and Mori, 1991 | gas phase; M |
By formula: COPt3- + CO = C2O2Pt3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53. ± 12. | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
By formula: C2O2Pt3- + CO = C3O3Pt3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.6 ± 5.3 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
ΔrH° | 49.2 ± 3.3 | kcal/mol | PDis | Shi, Spasov, et al., 2001 | gas phase; B |
By formula: C3CrO3- + CO = (C3CrO3- • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39.7 ± 3.9 | kcal/mol | CIDT | Sunderlin, Wang, et al., 1993 | gas phase; B |
By formula: C3MnO3- + CO = C4MnO4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.1 ± 3.0 | kcal/mol | CIDT | Sunderlin, Wang, et al., 1993 | gas phase; B |
By formula: C3O3Pt3- + CO = C4O4Pt3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 24.4 ± 3.2 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
By formula: C3O3V- + CO = C4O4V-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 40.4 ± 5.8 | kcal/mol | CIDT | Sunderlin, Wang, et al., 1993 | gas phase; B |
By formula: C4O4Pt3- + CO = C5O5Pt3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 26.1 ± 4.4 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
By formula: C4O4V- + CO = C5O5V-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 31.1 ± 3.0 | kcal/mol | CIDT | Sunderlin, Wang, et al., 1993 | gas phase; B |
By formula: C5O5Pt3- + CO = C6O6Pt3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.5 ± 6.9 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
ΔrH° | 39.7 ± 3.3 | kcal/mol | PDis | Shi, Spasov, et al., 2001 | gas phase; B |
By formula: C5O5V- + CO = C6O6V-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 30.8 ± 3.5 | kcal/mol | CIDT | Sunderlin, Wang, et al., 1993 | gas phase; B |
By formula: C6H5MnO- + CO = C6H5MnO-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.00 ± 0.50 | kcal/mol | N/A | Sunderlin and Squires, 1999 | gas phase; B |
By formula: C6H5MnO- + CO = C7H5MnO2-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.80 ± 0.60 | kcal/mol | N/A | Sunderlin and Squires, 1999 | gas phase; B |
By formula: C6O6Pt4- + CO = C8O8Pt4-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 18.4 ± 6.9 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
By formula: C7H5CrO2- + CO = C8H5CrO3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.70 ± 0.80 | kcal/mol | N/A | Sunderlin and Squires, 1999 | gas phase; B |
By formula: C7H5O2V- + CO = C7H5O2V-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.90 ± 0.70 | kcal/mol | N/A | Sunderlin and Squires, 1999 | gas phase; B |
By formula: C7H5O2V- + CO = C8H5O3V-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.60 ± 0.60 | kcal/mol | N/A | Sunderlin and Squires, 1999 | gas phase; B |
By formula: Co+ + CO = (Co+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41.6 ± 1.7 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 39. ± 3. | kcal/mol | MKER | Carpenter, van Koppen, et al., 1995 | gas phase; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
41.5 (+1.6,-0.) | CID | Goebel, Haynes, et al., 1995 | gas phase; guided ion beam CID; M | |
39.0 (+4.8,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Co+ • CO) + CO = (Co+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 36.6 ± 2.2 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
36.4 (+2.1,-0.) | CID | Goebel, Haynes, et al., 1995 | gas phase; guided ion beam CID; M | |
32.9 (+4.8,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Co+ • 2CO) + CO = (Co+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 19.6 ± 2.9 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
19.6 (+2.8,-0.) | CID | Goebel, Haynes, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Co+ • 3CO) + CO = (Co+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 17.9 ± 1.4 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18.0 (+1.4,-0.) | CID | Goebel, Haynes, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Co+ • 4CO) + CO = (Co+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 17.9 ± 1.2 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18.0 (+1.2,-0.) | CID | Goebel, Haynes, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: Cr+ + CO = (Cr+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 21.4 ± 0.9 | kcal/mol | CIDT | Khan, Clemmer, et al., 1993 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21.5 (+1.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • CO) + CO = (Cr+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 22.6 ± 0.7 | kcal/mol | CIDT | Khan, Clemmer, et al., 1993 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
22.7 (+0.7,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • 2CO) + CO = (Cr+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.9 ± 1.4 | kcal/mol | CIDT | Khan, Clemmer, et al., 1993 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12.9 (+1.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • 3CO) + CO = (Cr+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.2 ± 1.8 | kcal/mol | CIDT | Khan, Clemmer, et al., 1993 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12.2 (+1.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • 4CO) + CO = (Cr+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 14.8 ± 0.7 | kcal/mol | CIDT | Khan, Clemmer, et al., 1993 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
14.8 (+0.7,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Cr+ • 5CO) + CO = (Cr+ • 6CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31.0 (+1.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: Cu+ + CO = (Cu+ • CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
35.5 (+1.6,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Cu+ • CO) + CO = (Cu+ • 2CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
41.1 (+0.7,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Cu+ • 2CO) + CO = (Cu+ • 3CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
18.0 (+0.9,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: (Cu+ • 3CO) + CO = (Cu+ • 4CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12.6 (+0.7,-0.) | CID | Meyer, Chen, et al., 1995 | gas phase; guided ion beam CID; M |
By formula: Fe+ + CO = (Fe+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 30.8 ± 1.0 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 32. ± 3. | kcal/mol | MKER | Carpenter, van Koppen, et al., 1995 | gas phase; determined from MKER and theory; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
31.3 (+1.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • CO) + CO = (Fe+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 35.4 ± 1.2 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
36.1 (+3.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • 2CO) + CO = (Fe+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 16.5 ± 1.4 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15.8 (+1.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • 3CO) + CO = (Fe+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 23.4 ± 1.4 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
24.6 (+1.7,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • 4CO) + CO = (Fe+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 23.2 ± 1.0 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
26.8 (+1.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Fe+ • 3CO • 2Fe) + CO = (Fe+ • 4CO • 2Fe)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 56.9 | kcal/mol | PDiss | Tecklenberg, Bricker, et al., 1988 | gas phase; ΔrH<; M |
By formula: (Fe+ • Fe) + CO = (Fe+ • CO • Fe)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 58.6 | kcal/mol | PDiss | Tecklenberg, Bricker, et al., 1988 | gas phase; ΔrH<; M |
By formula: K+ + CO = (K+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.3 ± 1.2 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
By formula: Kr+ + CO = (Kr+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 24.7 ± 1.8 | kcal/mol | SIFT | Praxmarer, Jordan, et al., 1993 | gas phase; switching reaction(Kr+)Kr; Wadt, 1978, Radzig and Smirnov, 1985; M |
By formula: Li+ + CO = (Li+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 13.1 ± 3.1 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 13.1 ± 2.9 | kcal/mol | CIDT | Walter, Sievers, et al., 1998 | RCD |
By formula: (Li+ • CO) + CO = (Li+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.6 ± 1.0 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 8.6 ± 1.0 | kcal/mol | CIDT | Walter, Sievers, et al., 1998 | RCD |
By formula: (Li+ • 2CO) + CO = (Li+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.4 ± 1.0 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 8.4 ± 1.0 | kcal/mol | CIDT | Walter, Sievers, et al., 1998 | RCD |
By formula: Mg+ + CO = (Mg+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.9 ± 1.4 | kcal/mol | CIDT | Andersen, Muntean, et al., 2000 | RCD |
By formula: (Mg+ • CO) + CO = (Mg+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.2 ± 0.7 | kcal/mol | CIDT | Andersen, Muntean, et al., 2000 | RCD |
By formula: Mn+ + CO = (Mn+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7. | kcal/mol | KERDS | Dearden, Hayashibara, et al., 1989 | gas phase; ΔrH>; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
6.0 (+2.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • CO) + CO = (Mn+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 25. | kcal/mol | KERDS | Dearden, Hayashibara, et al., 1989 | gas phase; ΔrH<; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15.1 (+2.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • 2CO) + CO = (Mn+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 31. ± 6. | kcal/mol | KERDS | Dearden, Hayashibara, et al., 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
17.7 (+2.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • 3CO) + CO = (Mn+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 20. ± 3. | kcal/mol | KERDS | Dearden, Hayashibara, et al., 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15.5 (+2.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • 4CO) + CO = (Mn+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 16. ± 3. | kcal/mol | KERDS | Dearden, Hayashibara, et al., 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
28.9 (+2.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Mn+ • 5CO) + CO = (Mn+ • 6CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 32. ± 5. | kcal/mol | KERDS | Dearden, Hayashibara, et al., 1989 | gas phase; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
34.0 (+2.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: Na+ + CO = (Na+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.6 ± 1.9 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 7.6 ± 1.9 | kcal/mol | CIDT | Walter, Sievers, et al., 1998 | RCD |
ΔrH° | 12.6 | kcal/mol | HPMS | Castleman, Peterson, et al., 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 20.4 | cal/mol*K | HPMS | Castleman, Peterson, et al., 1983 | gas phase; M |
By formula: (Na+ • CO) + CO = (Na+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.7 ± 0.7 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
ΔrH° | 5.7 ± 0.7 | kcal/mol | CIDT | Walter, Sievers, et al., 1998 | RCD |
ΔrH° | 7.5 | kcal/mol | HPMS | Castleman, Peterson, et al., 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 15.1 | cal/mol*K | HPMS | Castleman, Peterson, et al., 1983 | gas phase; M |
By formula: Ni+ + CO = (Ni+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 39. ± 3. | kcal/mol | MKER | Carpenter, van Koppen, et al., 1995 | gas phase; determined from MKER and theory; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
41.7 (+2.5,-0.) | CID | Khan, Steele, et al., 1995 | gas phase; guided ion beam CID; M | |
42.5 (+2.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ni+ • CO) + CO = (Ni+ • 2CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
40.1 (+2.5,-0.) | CID | Khan, Steele, et al., 1995 | gas phase; guided ion bema CID; M | |
40.4 (+2.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ni+ • 2CO) + CO = (Ni+ • 3CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21.9 (+1.4,-0.) | CID | Khan, Steele, et al., 1995 | gas phase; guided ion beam CID; M | |
22.7 (+1.0,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (Ni+ • 3CO) + CO = (Ni+ • 4CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
17.3 (+0.7,-0.) | CID | Khan, Steele, et al., 1995 | gas phase; guided ion beam CID; M | |
17.2 (+1.2,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: O2- + CO = (O2- • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | <13.60 | kcal/mol | IMRB | Adams and Bohme, 1970 | gas phase; CO..O2- + O2 -> O4- + CO. G3MP2B3 calculations indicate a HOF(A-) ca. -38 kcal/mol; B |
By formula: Pt+ + CO = (Pt+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 50.7 ± 2.4 | kcal/mol | CIDT | Zhang and Armentrout, 2001 | RCD |
By formula: (Pt+ • CO) + CO = (Pt+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.1 ± 2.4 | kcal/mol | CIDT | Zhang and Armentrout, 2001 | RCD |
By formula: (Pt+ • 2CO) + CO = (Pt+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 23.4 ± 1.2 | kcal/mol | CIDT | Zhang and Armentrout, 2001 | RCD |
By formula: (Pt+ • 3CO) + CO = (Pt+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.7 ± 1.2 | kcal/mol | CIDT | Zhang and Armentrout, 2001 | RCD |
By formula: Pt3- + CO = COPt3-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 53.0 ± 6.9 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
By formula: Pt4- + CO = (Pt4- • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 60.0 ± 9.2 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
By formula: Pt5- + CO = (Pt5- • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 57.7 ± 9.2 | kcal/mol | N/A | Grushow and Ervin, 1997 | gas phase; B |
By formula: Ti+ + CO = (Ti+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 28.2 ± 1.4 | kcal/mol | CIDT | Meyer and Armentrout, 1996 | RCD |
By formula: (Ti+ • CO) + CO = (Ti+ • 2CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 27.0 ± 1.0 | kcal/mol | CIDT | Meyer and Armentrout, 1996 | RCD |
By formula: (Ti+ • 2CO) + CO = (Ti+ • 3CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 23.9 ± 1.0 | kcal/mol | CIDT | Meyer and Armentrout, 1996 | RCD |
By formula: (Ti+ • 3CO) + CO = (Ti+ • 4CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 20.8 ± 1.0 | kcal/mol | CIDT | Meyer and Armentrout, 1996 | RCD |
By formula: (Ti+ • 4CO) + CO = (Ti+ • 5CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 16.7 ± 1.0 | kcal/mol | CIDT | Meyer and Armentrout, 1996 | RCD |
By formula: (Ti+ • 5CO) + CO = (Ti+ • 6CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 17.7 ± 0.7 | kcal/mol | CIDT | Meyer and Armentrout, 1996 | RCD |
By formula: (Ti+ • 6CO) + CO = (Ti+ • 7CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.4 ± 1.7 | kcal/mol | CIDT | Meyer and Armentrout, 1996 | RCD |
By formula: V+ + CO = (V+ • CO)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 28.7 ± 3.3 | kcal/mol | CID | Armentrout and Kickel, 1994 | gas phase; ΔrH(0 K0, guided ion beam CID; M |
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
27.0 (+0.7,-0.) | CID | Sievers and Armentrout, 1995 | gas phase; guided ion beam CID; M |
By formula: (V+ • CO) + CO = (V+ • 2CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21.7 (+0.7,-0.) | CID | Sievers and Armentrout, 1995 | gas phase; guided ion beam CID; M | |
25.3 (+1.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • 2CO) + CO = (V+ • 3CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16.6 (+0.9,-0.) | CID | Sievers and Armentrout, 1995 | gas phase; guided ion beam CID; M | |
14.6 (+2.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • 3CO) + CO = (V+ • 4CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
20.5 (+2.3,-0.) | CID | Sievers and Armentrout, 1995 | gas phase; guided ion beam CID; M | |
22.7 (+3.4,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • 4CO) + CO = (V+ • 5CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
21.7 (+0.7,-0.) | CID | Sievers and Armentrout, 1995 | gas phase; guided ion beam CID; M | |
22.2 (+1.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • 5CO) + CO = (V+ • 6CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
23.8 (+1.6,-0.) | CID | Sievers and Armentrout, 1995 | gas phase; guided ion beam CID; M | |
29.6 (+1.9,-0.) | CID | Armentrout and Kickel, 1994 | gas phase; guided ion beam CID; M |
By formula: (V+ • 6CO) + CO = (V+ • 7CO)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
12.0 (+2.1,-0.) | CID | Sievers and Armentrout, 1995 | gas phase; guided ion beam CID; M |
References
Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
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Notes
Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, References
- Symbols used in this document:
AE Appearance energy EA Electron affinity IE (evaluated) Recommended ionization energy Pc Critical pressure S°gas,1 bar Entropy of gas at standard conditions (1 bar) T Temperature Tboil Boiling point Tc Critical temperature Ttriple Triple point temperature d(ln(kH))/d(1/T) Temperature dependence parameter for Henry's Law constant k°H Henry's Law constant at 298.15K ΔfH(+) ion,0K Enthalpy of formation of positive ion at 0K 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 ΔsubH Enthalpy of sublimation ΔvapH Enthalpy of vaporization ρc Critical density - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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