tert-Butyl, positive ion
- Formula: C4H9+
- Molecular weight: 57.1137
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Reaction thermochemistry data
Go To: Top, 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: Michael M. Meot-Ner (Mautner) and Sharon G. Lias
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.
Individual Reactions
By formula: C4H9+ + H3N = (C4H9+ • H3N)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 46.8 | kcal/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1991 | gas phase; forms t-C4H9NH3+ |
ΔrH° | 45.3 | kcal/mol | PHPMS | Szulejko and McMahon, 1991 | gas phase; forms t-C4H9NH3+ |
ΔrH° | 46.5 | kcal/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1990 | gas phase; forms t-C4H9NH3+ |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 43.7 | cal/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1991 | gas phase; forms t-C4H9NH3+ |
ΔrS° | 47.3 | cal/mol*K | PHPMS | Szulejko and McMahon, 1991 | gas phase; forms t-C4H9NH3+ |
ΔrS° | 44.0 | cal/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1990 | gas phase; forms t-C4H9NH3+ |
By formula: C4H9+ + C7H8 = (C4H9+ • C7H8)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 28.6 | kcal/mol | PHPMS | Stone and Stone, 1991 | gas phase; toluene D8, forms protonated t-butyltoluene |
ΔrH° | 29.1 | kcal/mol | PHPMS | Stone and Stone, 1991 | gas phase; forms protomated t-butyltoluene |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 54.5 | cal/mol*K | PHPMS | Stone and Stone, 1991 | gas phase; toluene D8, forms protonated t-butyltoluene |
ΔrS° | 54.6 | cal/mol*K | PHPMS | Stone and Stone, 1991 | gas phase; forms protomated t-butyltoluene |
By formula: (C4H9+ • 3H2O) + H2O = (C4H9+ • 4H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 14. | kcal/mol | PHPMS | Hiraoka and Kebarle, 1977 | gas phase; may form ((CH3)3COH2+) 3H2O |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 28.7 | cal/mol*K | PHPMS | Hiraoka and Kebarle, 1977 | gas phase; may form ((CH3)3COH2+) 3H2O |
By formula: (C4H9+ • 2H2O) + H2O = (C4H9+ • 3H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 17.7 | kcal/mol | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; may form ((CH3)3COH2+) 2H2O |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 29. | cal/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase; may form ((CH3)3COH2+) 2H2O |
By formula: C4H9+ + C6H6 = (C4H9+ • C6H6)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 22. | kcal/mol | PHPMS | Sen Sharma, Ikuta, et al., 1982 | gas phase; forms protonated t-butylbenzene |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 49. | cal/mol*K | PHPMS | Sen Sharma, Ikuta, et al., 1982 | gas phase; forms protonated t-butylbenzene |
By formula: C4H9+ + CHN = (C4H9+ • CHN)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 16.3 | kcal/mol | PHPMS | Meot-Ner (Mautner), 1978 | gas phase; may form t-C4H9NCH+ |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 25. | cal/mol*K | PHPMS | Meot-Ner (Mautner), 1978 | gas phase; may form t-C4H9NCH+ |
By formula: C4H9+ + C2H6S = (C4H9+ • C2H6S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.2 | kcal/mol | PHPMS | Meot-Ner (Mautner) and Sieck, 1991 | gas phase; condensation |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 42.6 | cal/mol*K | PHPMS | Meot-Ner (Mautner) and Sieck, 1991 | gas phase; condensation |
By formula: C4H9+ + F2O2S = (C4H9+ • F2O2S)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10.4 | kcal/mol | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 10.4 | cal/mol*K | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
By formula: C4H9+ + CHCl3 = (C4H9+ • CHCl3)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.1 | kcal/mol | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 23.6 | cal/mol*K | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
By formula: C4H9+ + CH3Cl = (C4H9+ • CH3Cl)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.4 | kcal/mol | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 19.3 | cal/mol*K | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
By formula: C4H9+ + C3H8 = (C4H9+ • C3H8)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.6 | kcal/mol | PHPMS | Sunner, Hirao, et al., 1989 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22.3 | cal/mol*K | PHPMS | Sunner, Hirao, et al., 1989 | gas phase |
By formula: C4H9+ + C2H5Cl = (C4H9+ • C2H5Cl)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.2 | kcal/mol | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 16.3 | cal/mol*K | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
By formula: C4H9+ + CH2Cl2 = (C4H9+ • CH2Cl2)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 9.5 | kcal/mol | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22.3 | cal/mol*K | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
By formula: C4H9+ + CHF3 = (C4H9+ • CHF3)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 6.8 | kcal/mol | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 19.8 | cal/mol*K | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
By formula: C4H9+ + CF4 = (C4H9+ • CF4)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3.4 | kcal/mol | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 10.4 | cal/mol*K | PHPMS | Sharma, Meza de Hojer, et al., 1985 | gas phase |
By formula: C4H9+ + H2O = (C4H9+ • H2O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 11.2 | kcal/mol | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 22. | cal/mol*K | PHPMS | Hiraoka and Kebarle, 1977, 2 | gas phase |
References
Go To: Top, Reaction thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Meot-Ner (Mautner) and Sieck, 1991
Meot-Ner (Mautner), M.; Sieck, L.W.,
Proton affinity ladders from variable-temperature equilibrium measurements. 1. A reevaluation of the upper proton affinity range,
J. Am. Chem. Soc., 1991, 113, 12, 4448, https://doi.org/10.1021/ja00012a012
. [all data]
Szulejko and McMahon, 1991
Szulejko, J.E.; McMahon, T.B.,
A Pulsed Electron Beam, Variable Temperature, High Pressure Mass Spectrometric Reevaluation of the Proton Affinity Difference Between 2-Methylpropene and Ammonia,
Int. J. Mass Spectrom. Ion Proc., 1991, 109, 279, https://doi.org/10.1016/0168-1176(91)85109-Y
. [all data]
Meot-Ner (Mautner) and Sieck, 1990
Meot-Ner (Mautner), M.; Sieck, L.W.,
Ion Thermochemistry at High Temperatures. 1. Thermochemistry of the Ammonium Ion from Variable - Temperature Equilibrium Measurements. Proton Transfer, Association, and Decomposition Reactions in Ammonia, Isobutene, and t-Butylamine,
J. Phys. Chem., 1990, 94, 19, 7730, https://doi.org/10.1021/j100382a076
. [all data]
Stone and Stone, 1991
Stone, J.M.; Stone, J.A.,
A High Pressure Mass Spectrometric Study of the Binding of (CH3)3Si+ and (CH3)3C+ to Toluene and Benzene,
Int. J. Mass Spectrom. Ion Proc., 1991, 109, 247, https://doi.org/10.1016/0168-1176(91)85107-W
. [all data]
Hiraoka and Kebarle, 1977
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]
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]
Sen Sharma, Ikuta, et al., 1982
Sen Sharma, D.K.; Ikuta, S.; Kebarle, P.,
Alkylation of Benzene by Alkyl Cations. Stability of the tert - Butyl Benzenium Ion,
Can. J. Chem., 1982, 60, 18, 2325, https://doi.org/10.1139/v82-331
. [all data]
Meot-Ner (Mautner), 1978
Meot-Ner (Mautner), M.,
Solvation of the Proton by HCN and CH3CN. Condensation of HCN with Ions in the Gas Phase.,
J. Am. Chem. Soc., 1978, 100, 15, 4694, https://doi.org/10.1021/ja00483a012
. [all data]
Sharma, Meza de Hojer, et al., 1985
Sharma, D.M.S.; Meza de Hojer, S.; Kebarle, P.,
Stabilities of halonium ions from a study of gas-phase equilibria R+ + XR' = (RXR')+,
J. Am. Chem. Soc., 1985, 107, 13, 3757, https://doi.org/10.1021/ja00299a002
. [all data]
Sunner, Hirao, et al., 1989
Sunner, J.A.; Hirao, K.; Kebarle, P.,
Hydride - Transfer Reactions. Temperature Dependence of Rate Constants for i-C3H7+ + HC(CH3)3 = C3H8 + C(CH3)3+. Clusters of i-C3H7+ and t-C4H9+ with Propane and Isobutane,
J. Phys. Chem., 1989, 93, 10, 4010, https://doi.org/10.1021/j100347a030
. [all data]
Notes
Go To: Top, Reaction thermochemistry data, References
- Symbols used in this document:
ΔrH° Enthalpy of reaction at standard conditions ΔrS° Entropy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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