Oxygen
- Formula: O2
- Molecular weight: 31.9988
- IUPAC Standard InChIKey: MYMOFIZGZYHOMD-UHFFFAOYSA-N
- CAS Registry Number: 7782-44-7
- 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: Molecular oxygen; Oxygen molecule; Pure oxygen; O2; Liquid oxygen; UN 1072; UN 1073; Dioxygen
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Phase change data
Go To: Top, Reaction thermochemistry 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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 90.2 | K | N/A | Streng, 1971 | Uncertainty assigned by TRC = 0.2 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 54.8 | K | N/A | Streng, 1971 | Uncertainty assigned by TRC = 0.2 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 54.33 | K | N/A | Henning and Otto, 1936 | Uncertainty assigned by TRC = 0.06 K; temperature measured with He gas thermometer; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 154.58 | K | N/A | Pentermann and Wagner, 1978 | Uncertainty assigned by TRC = 0.0015 K; TRC |
Tc | 154.58 | K | N/A | Wagner, Ewers, et al., 1976 | Uncertainty assigned by TRC = 0.0015 K; TRC |
Tc | 155.15 | K | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.3 K; 4 determinations with same result; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 50.43 | bar | N/A | Wagner, Ewers, et al., 1976 | Uncertainty assigned by TRC = 0.005 bar; Vapour-pressure measurements give pc=5.04332 MPa at Tc from L.A.Weber, 1970 PRT, IPTS-68, PP+ differential pressure transducer.; TRC |
Pc | 50.0343 | bar | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.3039 bar; TRC |
Pc | 49.9228 | bar | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.3039 bar; TRC |
Pc | 49.8519 | bar | N/A | Cardoso, 1915 | Uncertainty assigned by TRC = 0.3039 bar; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ρc | 13.60 | mol/l | N/A | Pentermann and Wagner, 1978 | Uncertainty assigned by TRC = 0.014 mol/l; from density measurements 65 to 300 K, Tc from Weber, 1970; 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 |
---|---|---|---|---|---|
54.36 to 100.16 | 3.85845 | 325.675 | -5.667 | Brower and Thodos, 1968 | Coefficents calculated by NIST from author's data. |
54.36 to 154.33 | 3.9523 | 340.024 | -4.144 | Brower and Thodos, 1968 | Coefficents calculated by NIST from author's data. |
Reaction thermochemistry data
Go To: Top, Phase change 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:
B - John E. Bartmess
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Reactions 1 to 50
By formula: O2- + O2 = (O2- • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48. ± 20. | kJ/mol | AVG | N/A | Average of 5 out of 7 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 102. | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrS° | 130. | J/mol*K | PHPMS | Conway and Nesbit, 1968 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 13. ± 4.6 | kJ/mol | TDAs | Hiraoka, 1888 | gas phase; see also Sherwood, Hanold, et al., 1996. Aquino, Taylor, et al., 2001 calns indicate rectangular anion; B |
ΔrG° | 23. ± 4.2 | kJ/mol | IMRE | Payzant J.D. and Kebarle, 1972 | gas phase; B |
ΔrG° | 13. ± 4.2 | kJ/mol | IMRE | Pack and Phelps, 1971 | gas phase; B |
ΔrG° | 16.7 ± 2.1 | kJ/mol | IMRE | Parkes, 1971 | gas phase; B |
ΔrG° | 16. ± 4.2 | kJ/mol | TDAs | Conway and Nesbit, 1968 | gas phase; B |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
15. | 300. | DT | Pack and Phelps, 1971 | gas phase; M |
By formula: O2+ + O2 = (O2+ • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 41. ± 5. | kJ/mol | AVG | N/A | Average of 5 out of 6 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.7 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrS° | 104.7 | J/mol*K | PHPMS | Conway and Janik, 1970 | gas phase; M |
ΔrS° | 84. | J/mol*K | PHPMS | Durden, Kebarle, et al., 1969 | gas phase; M |
ΔrS° | 86.2 | J/mol*K | PHPMS | Yang and Conway, 1964 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
16. | 300. | DT | Rakshit and Warneck, 1981 | gas phase; M |
14. | 300. | DT | Rakshit and Warneck, 1980 | gas phase; M |
14. | 296. | FA | Howard, Bierbaum, et al., 1972 | gas phase; M |
25. | 200. | FA | Adams and Bohme, 1970 | gas phase; M |
By formula: (HO2+ • 2O2) + O2 = (HO2+ • 3O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 11. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrH° | 13. | kJ/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 76.6 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrS° | 84. | J/mol*K | N/A | Hiraoka, Saluja, et al., 1979 | gas phase; Entropy change calculated or estimated; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
4.6 | 105. | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; Entropy change calculated or estimated; M |
By formula: (O2- • 7N2 • O2) + N2 = (O2- • 8N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7. ± 1. | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
ΔrH° | 6.40 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 74.9 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
ΔrS° | 75.3 | J/mol*K | N/A | Hiraoka, 1988, 2 | gas phase; Entropy change calculated or estimated; M |
By formula: O- + O2 = (O- • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 130. | kJ/mol | PDiss | Hiller and Vestal, 1981 | gas phase; From thermochemical cycle, ΔrH<; M |
ΔrH° | 163. | kJ/mol | PES | Novich, Engelking, et al., 1979 | gas phase; From thermochemical cycle, from EA(O3), D(O-O2) AND EA(O); M |
ΔrH° | 160. | kJ/mol | PDiss | Cosby, Moseley, et al., 1978 | gas phase; M |
ΔrH° | 180. | kJ/mol | CID | Lifschitz, Wu, et al., 1978 | gas phase; M |
By formula: (O2+ • O2) + O2 = (O2+ • 2O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 25. ± 1. | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrH° | 28.7 ± 0.3 | kJ/mol | PHPMS | Conway and Janik, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 110. | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrS° | 133.0 | J/mol*K | PHPMS | Conway and Janik, 1970 | gas phase; M |
By formula: (HO2+ • O2) + O2 = (HO2+ • 2O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 29. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrH° | 28. | kJ/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 96.7 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
ΔrS° | 92. | J/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
By formula: (O2+ • 3O2) + O2 = (O2+ • 4O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.0 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrH° | 10.3 ± 0.75 | kJ/mol | PHPMS | Conway and Janik, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.7 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrS° | 100. | J/mol*K | PHPMS | Conway and Janik, 1970 | gas phase; M |
By formula: (O2+ • 2O2) + O2 = (O2+ • 3O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10.4 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrH° | 10.6 ± 0.4 | kJ/mol | PHPMS | Conway and Janik, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.2 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrS° | 82.8 | J/mol*K | PHPMS | Conway and Janik, 1970 | gas phase; M |
By formula: (O2+ • 4O2) + O2 = (O2+ • 5O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.0 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrH° | 8. ± 3. | kJ/mol | PHPMS | Conway and Janik, 1970 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.5 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
ΔrS° | 71.1 | J/mol*K | PHPMS | Conway and Janik, 1970 | gas phase; M |
By formula: O3- + O2 = (O3- • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.79 ± 0.84 | kJ/mol | TDAs | Hiraoka, 1988, 2 | gas phase; B,M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 79.5 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | -15.1 ± 2.1 | kJ/mol | TDAs | Hiraoka, 1988, 2 | gas phase; B |
By formula: NO- + O2 = (NO- • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.1 ± 0.8 | kJ/mol | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 60.7 | J/mol*K | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
Free energy of reaction
ΔrG° (kJ/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
-2. | 200. | FA | Dunkin, Fehsenfeld, et al., 1971 | gas phase; DG>; M |
By formula: (O2- • 6O2) + O2 = (O2- • 7O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.86 | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 67. | J/mol*K | N/A | Hiraoka, 1988 | gas phase; Entropy change calculated or estimated; M |
By formula: (O2+ • 7O2) + O2 = (O2+ • 8O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.61 | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; Entropy change calculated or estimated; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | N/A | Hiraoka, 1988 | gas phase; Entropy change calculated or estimated; M |
By formula: (O2+ • O2) + N2 = (O2+ • N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12. | kJ/mol | HPMS | Speller and Fitaire, 1983 | gas phase; Entropy change is questionable; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 42.3 | J/mol*K | HPMS | Speller and Fitaire, 1983 | gas phase; Entropy change is questionable; M |
By formula: (H3+ • O2) + O2 = (H3+ • 2O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 48.1 | kJ/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; From thermochemical cycle(O2H+)O2; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 92. | J/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; From thermochemical cycle(O2H+)O2; M |
By formula: (O3- • 4O2) + O2 = (O3- • 5O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.44 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; ΔrH, ΔrS approximate; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 68.6 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; ΔrH, ΔrS approximate; M |
By formula: H3+ + O2 = (H3+ • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 52.3 | kJ/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; From thermochemical cycle(O2H+)O2; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 82.0 | J/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; From thermochemical cycle(O2H+)O2; M |
(O2S- • 2 • ) + = (O2S- • 3 • )
By formula: (O2S- • 2O2S • O2) + O2S = (O2S- • 3O2S • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 15.1 ± 1.7 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 6. ± 13. | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
By formula: (O2S- • O2S • O2) + O2S = (O2S- • 2O2S • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 19.2 ± 1.7 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 10. ± 8.4 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
By formula: (O3S- • O2S • O2) + O2S = (O3S- • 2O2S • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 23.8 ± 2.5 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 15. ± 8.8 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
By formula: O+ + O2 = (O+ • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 179. | kJ/mol | PDiss | Hiller and Vestal, 1982 | gas phase; M |
ΔrH° | 200. | kJ/mol | PI | Linn, Ono, et al., 1981 | gas phase; M |
ΔrH° | 209. | kJ/mol | PDiss | Mosely, Ozenne, et al., 1981 | gas phase; M |
By formula: (O3S- • O2) + O2S = (O3S- • O2S • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 27.2 ± 3.3 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 18. ± 9.2 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
By formula: (O2S- • O2) + O2S = (O2S- • O2S • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.0 ± 4.2 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 26. ± 9.2 | kJ/mol | TDAs | Vacher, Jorda, et al., 1992 | gas phase; B |
By formula: (O2- • 2N2 • O2) + N2 = (O2- • 3N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10.3 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 76.6 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
By formula: (O2- • 3N2 • O2) + N2 = (O2- • 4N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.0 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.2 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
By formula: (O2- • 4N2 • O2) + N2 = (O2- • 5N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.1 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 81.6 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
By formula: (O2- • 5N2 • O2) + N2 = (O2- • 6N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.6 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 81.6 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
By formula: (O2- • 6N2 • O2) + N2 = (O2- • 7N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.1 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 78.7 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
By formula: (O2- • N2 • O2) + N2 = (O2- • 2N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 11.7 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 74.9 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
By formula: (NO- • 2O2) + O2 = (NO- • 3O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 11.8 ± 0.8 | kJ/mol | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 65.7 | J/mol*K | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
By formula: (NO- • 3O2) + O2 = (NO- • 4O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10.2 ± 0.8 | kJ/mol | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 67.4 | J/mol*K | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
By formula: (NO- • 4O2) + O2 = (NO- • 5O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.8 ± 0.8 | kJ/mol | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 80.3 | J/mol*K | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
By formula: (NO- • O2) + O2 = (NO- • 2O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.1 ± 0.8 | kJ/mol | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 65.7 | J/mol*K | PHPMS | Hiraoka and Yamabe, 1991 | gas phase; M |
By formula: (HO2+ • 3O2) + O2 = (HO2+ • 4O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 11. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.3 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (HO2+ • 4O2) + O2 = (HO2+ • 5O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.6 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (HO2+ • 5O2) + O2 = (HO2+ • 6O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 93.3 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (HO2+ • 6O2) + O2 = (HO2+ • 7O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 94.1 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (HO2+ • 7O2) + O2 = (HO2+ • 8O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 88.3 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (HO2+ • 8O2) + O2 = (HO2+ • 9O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7. ± 1. | kJ/mol | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 86.2 | J/mol*K | PHPMS | Hiraoka and Mori, 1989 | gas phase; M |
By formula: (HO2+ • O2) + H2 = (HO2+ • H2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 17. | kJ/mol | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 71. | J/mol*K | PHPMS | Hiraoka, Saluja, et al., 1979 | gas phase; M |
By formula: (O2- • O2) + N2 = (O2- • N2 • O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 12.0 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 69.0 | J/mol*K | PHPMS | Hiraoka, 1988, 2 | gas phase; M |
By formula: 2C2H6S + O2 = 2C2H6OS
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -277.7 ± 0.84 | kJ/mol | Cm | Douglas, 1946 | liquid phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -278.3 ± 0.8 kJ/mol; At 291°K; ALS |
By formula: C2H6O2S = C2H6OS + 0.5O2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 243.3 ± 0.84 | kJ/mol | Cm | Douglas, 1946 | liquid phase; Reanalyzed by Cox and Pilcher, 1970, Original value = 246.9 ± 0.8 kJ/mol; At 291°K; ALS |
By formula: (O2- • 2O2) + O2 = (O2- • 3O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10.0 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 89.1 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
By formula: (O2- • 3O2) + O2 = (O2- • 4O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7. ± 1. | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 64.4 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
By formula: (O2- • 4O2) + O2 = (O2- • 5O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.4 ± 0.8 | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 64.4 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
By formula: (O2- • 5O2) + O2 = (O2- • 6O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6. ± 1. | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 67.8 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
By formula: (O2+ • 5O2) + O2 = (O2+ • 6O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8. ± 1. | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 90.8 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
By formula: (O2+ • 6O2) + O2 = (O2+ • 7O2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8. ± 2. | kJ/mol | PHPMS | Hiraoka, 1988 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 91.6 | J/mol*K | PHPMS | Hiraoka, 1988 | gas phase; M |
Gas phase ion energetics data
Go To: Top, Phase change data, Reaction thermochemistry 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:
B - John E. Bartmess
MM - Michael M. Meot-Ner (Mautner)
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 O2+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
IE (evaluated) | 12.0697 ± 0.0002 | eV | N/A | N/A | L |
Quantity | Value | Units | Method | Reference | Comment |
Proton affinity (review) | 421. | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 396.3 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Electron affinity determinations
EA (eV) | Method | Reference | Comment |
---|---|---|---|
0.4480 ± 0.0060 | LPES | Ervin, Anusiewicz, et al., 2003 | B |
0.4510 ± 0.0070 | LPES | Travers, Cowles, et al., 1989 | B |
0.4400 ± 0.0080 | LPES | Celotta, Bennett, et al., 1972 | 89SAW puts DH(H-O2.) at 59 kcal/mol, implying ΔHacid=362.5; B |
0.451 ± 0.052 | ECD | Chen and Wentworth, 1983 | B |
0.44 ± 0.10 | CIDT | Tiernan and Wu, 1978 | From O2-; B |
0.40 ± 0.10 | NBIE | Durup, Parlant, et al., 1977 | B |
0.450 ± 0.024 | ETS | Burrow, 1974 | B |
0.50 ± 0.10 | NBIE | Baeda, 1972 | B |
0.430 ± 0.030 | LPES | Celotta, Bennett, et al., 1971 | B |
0.460 ± 0.050 | NBIE | Nalley and Compton, 1971 | B |
>0.45 ± 0.10 | Endo | Tiernan, Hughes, et al., 1971 | B |
0.50 ± 0.20 | NBIE | Lacmann and Herschbach, 1970 | B |
0.430 ± 0.020 | Kine | Pack and Phelps, 1966 | B |
>0.479998 | Endo | Berkowitz, Chupka, et al., 1971 | B |
>0.56 ± 0.10 | Endo | Chantry, 1971 | B |
0.725005 | ECD | Chen and Chen, 2003 | B |
>1.27 ± 0.20 | Endo | Bailey and Mahadevan, 1970 | B |
1.119 ± 0.069 | IMRB | Vogt, Hauffle, et al., 1970 | B |
>1.10 ± 0.10 | EIAE | Stockdale, Compton, et al., 1969 | From NO2; B |
0.150 ± 0.050 | PD | Burch, Smith, et al., 1958 | B |
Proton affinity at 298K
Proton affinity (kJ/mol) | Reference | Comment |
---|---|---|
421. ± 3. | Litorja and Ruscic, 1998 | T = 298K; MM |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
12.0697 ± 0.0002 | S | Tonkyn, Winniczek, et al., 1989 | LL |
12.1 ± 0.1 | EI | Grade, Wienecke, et al., 1983 | LBLHLM |
12.8 ± 0.5 | EI | Gomez, Chatillon, et al., 1982 | LBLHLM |
12.0 ± 1.0 | S | Farber, Srivastava, et al., 1982 | LBLHLM |
12.076 ± 0.002 | PE | MacNeil and Dixon, 1977 | LLK |
12.071 | PE | Kronebusch and Berkowitz, 1976 | LLK |
12.071 ± 0.001 | PE | Samson and Gardner, 1975 | LLK |
12.0 ± 0.5 | EI | Hildenbrand, 1975 | LLK |
12.2 ± 0.2 | EI | Bennett, Lin, et al., 1974 | LLK |
12.07 ± 0.01 | PI | Tanaka and Tanaka, 1973 | LLK |
12.08 | PE | Natalis, 1973 | LLK |
12.077 | PE | Dromey, Morrison, et al., 1973 | LLK |
12.127 | PE | Vilesov and Lopatin, 1972 | LLK |
12.072 ± 0.008 | PI | Dibeler and Walker, 1967 | RDSH |
12.059 ± 0.001 | S | Samson and Cairns, 1966 | RDSH |
12.078 ± 0.005 | PI | Brehm, 1966 | RDSH |
12.065 ± 0.003 | PI | Nicholson, 1963 | RDSH |
12.08 ± 0.01 | PI | Watanabe, 1957 | RDSH |
12.30 | PE | Kimura, Katsumata, et al., 1981 | Vertical value; LLK |
12.33 ± 0.01 | PE | Banna and Shirley, 1976 | Vertical value; LLK |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
O+ | 18.734 | O | PIPECO | Blyth, Powis, et al., 1981 | LLK |
O+ | 17.28 | O- | PI | Oertel, Schenk, et al., 1980 | LLK |
O+ | 18.69 ± 0.04 | O | EI | Locht and Schopman, 1974 | LLK |
O+ | 17.3 ± 0.2 | O- | EI | Locht and Momigny, 1971 | LLK |
O+ | 17.25 ± 0.01 | O- | PI | Dibeler and Walker, 1967 | RDSH |
O+ | 17.272 ± 0.024 | O- | PI | Elder, Villarejo, et al., 1965 | RDSH |
O+ | 18.8 ± 0.4 | O | PI | Weissler, Samson, et al., 1959 | RDSH |
O+ | 18.99 ± 0.05 | O | EI | Frost and McDowell, 1959 | RDSH |
Anion protonation reactions
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1476.9 ± 3.0 | kJ/mol | D-EA | Travers, Cowles, et al., 1989 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 1450.5 ± 3.4 | kJ/mol | H-TS | Travers, Cowles, et al., 1989 | gas phase; B |
References
Go To: Top, Phase change data, Reaction thermochemistry data, Gas phase ion energetics 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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Stockdale, Compton, et al., 1969
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Notes
Go To: Top, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, References
- Symbols used in this document:
AE Appearance energy EA Electron affinity IE (evaluated) Recommended ionization energy Pc Critical pressure T Temperature Tboil Boiling point Tc Critical temperature Tfus Fusion (melting) point Ttriple Triple point temperature 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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