Benzene, positive ion


Reaction thermochemistry data

Go To: Top, 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: 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

C6H6+ + Benzene = (C6H6+ • Benzene)

By formula: C6H6+ + C6H6 = (C6H6+ • C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr14. ± 8.kcal/molAVGN/AAverage of 7 out of 10 values; Individual data points
Quantity Value Units Method Reference Comment
Δr28.8cal/mol*KPHPMSHiraoka, Fujimaki, et al., 1991gas phase
Δr27.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Δr23.cal/mol*KHPMSField, Hamlet, et al., 1969gas phase

C6H6+ + Benzene, 1,2,3,5-tetrafluoro- = (C6H6+ • Benzene, 1,2,3,5-tetrafluoro-)

By formula: C6H6+ + C6H2F4 = (C6H6+ • C6H2F4)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr11.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.1300.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Benzene, pentafluoro- = (C6H6+ • Benzene, pentafluoro-)

By formula: C6H6+ + C6HF5 = (C6H6+ • C6HF5)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr11.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.1300.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Benzene, 1,2-difluoro- = (C6H6+ • Benzene, 1,2-difluoro-)

By formula: C6H6+ + C6H4F2 = (C6H6+ • C6H4F2)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr15.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.3330.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Benzene, hexafluoro- = (C6H6+ • Benzene, hexafluoro-)

By formula: C6H6+ + C6F6 = (C6H6+ • C6F6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr12.1kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
4.0300.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Cyclohexane = (C6H6+ • Cyclohexane)

By formula: C6H6+ + C6H12 = (C6H6+ • C6H12)

Quantity Value Units Method Reference Comment
Δr11.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.2295.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Benzene, fluoro- = (C6H6+ • Benzene, fluoro-)

By formula: C6H6+ + C6H5F = (C6H6+ • C6H5F)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr6.6kcal/molPIRuhl, Bisling, et al., 1986gas phase; from vIP of perpendicular dimer
Δr17.0kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr30.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

(C6H6+ • 2Benzene) + Benzene = (C6H6+ • 3Benzene)

By formula: (C6H6+ • 2C6H6) + C6H6 = (C6H6+ • 3C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.0kcal/molPHPMSHiraoka, Fujimaki, et al., 1991gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/AHiraoka, Fujimaki, et al., 1991gas phase; Entropy change calculated or estimated

(C6H6+ • Benzene) + Benzene = (C6H6+ • 2Benzene)

By formula: (C6H6+ • C6H6) + C6H6 = (C6H6+ • 2C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.8 ± 0.5kcal/molPHPMSHiraoka, Fujimaki, et al., 1991gas phase
Quantity Value Units Method Reference Comment
Δr19.8cal/mol*KPHPMSHiraoka, Fujimaki, et al., 1991gas phase

C6H6+ + Benzene, 1,2,4,5-tetrafluoro- = (C6H6+ • Benzene, 1,2,4,5-tetrafluoro-)

By formula: C6H6+ + C6H2F4 = (C6H6+ • C6H2F4)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr12.0kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + Benzene, 1,3-difluoro- = (C6H6+ • Benzene, 1,3-difluoro-)

By formula: C6H6+ + C6H4F2 = (C6H6+ • C6H4F2)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr13.9kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr26.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + 1,3,5-Trifluorobenzene = (C6H6+ • 1,3,5-Trifluorobenzene)

By formula: C6H6+ + C6H3F3 = (C6H6+ • C6H3F3)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr12.4kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr28.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + Carbon disulfide = (C6H6+ • Carbon disulfide)

By formula: C6H6+ + CS2 = (C6H6+ • CS2)

Quantity Value Units Method Reference Comment
Δr12.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr24.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

(C6H6+ • 10Benzene) + Benzene = (C6H6+ • 11Benzene)

By formula: (C6H6+ • 10C6H6) + C6H6 = (C6H6+ • 11C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.8kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 11Benzene) + Benzene = (C6H6+ • 12Benzene)

By formula: (C6H6+ • 11C6H6) + C6H6 = (C6H6+ • 12C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.0kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 12Benzene) + Benzene = (C6H6+ • 13Benzene)

By formula: (C6H6+ • 12C6H6) + C6H6 = (C6H6+ • 13C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.3kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 13Benzene) + Benzene = (C6H6+ • 14Benzene)

By formula: (C6H6+ • 13C6H6) + C6H6 = (C6H6+ • 14C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.1kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 9Benzene) + Benzene = (C6H6+ • 10Benzene)

By formula: (C6H6+ • 9C6H6) + C6H6 = (C6H6+ • 10C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.8kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 5Benzene) + Benzene = (C6H6+ • 6Benzene)

By formula: (C6H6+ • 5C6H6) + C6H6 = (C6H6+ • 6C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.5kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 6Benzene) + Benzene = (C6H6+ • 7Benzene)

By formula: (C6H6+ • 6C6H6) + C6H6 = (C6H6+ • 7C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.3kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 7Benzene) + Benzene = (C6H6+ • 8Benzene)

By formula: (C6H6+ • 7C6H6) + C6H6 = (C6H6+ • 8C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.0kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 8Benzene) + Benzene = (C6H6+ • 9Benzene)

By formula: (C6H6+ • 8C6H6) + C6H6 = (C6H6+ • 9C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.9kcal/molPDissBeck and Hecht, 1991gas phase

C6H6+ + Benzene, 1,4-difluoro- = (C6H6+ • Benzene, 1,4-difluoro-)

By formula: C6H6+ + C6H4F2 = (C6H6+ • C6H4F2)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr11.3kcal/molMPIErnstberger, Krause, et al., 1990gas phase

C6H6+ + Hydrogen chloride = (C6H6+ • Hydrogen chloride)

By formula: C6H6+ + HCl = (C6H6+ • HCl)

Quantity Value Units Method Reference Comment
Δr7.3kcal/molPIWalters, Grover, et al., 1985gas phase

Ion clustering data

Go To: Top, 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 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. Searches may be limited to ion clustering reactions. A general reaction search form is also available.

Clustering reactions

C6H6+ + Carbon disulfide = (C6H6+ • Carbon disulfide)

By formula: C6H6+ + CS2 = (C6H6+ • CS2)

Quantity Value Units Method Reference Comment
Δr12.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr24.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + Benzene, hexafluoro- = (C6H6+ • Benzene, hexafluoro-)

By formula: C6H6+ + C6F6 = (C6H6+ • C6F6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr12.1kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
4.0300.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Benzene, pentafluoro- = (C6H6+ • Benzene, pentafluoro-)

By formula: C6H6+ + C6HF5 = (C6H6+ • C6HF5)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr11.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.1300.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Benzene, 1,2,4,5-tetrafluoro- = (C6H6+ • Benzene, 1,2,4,5-tetrafluoro-)

By formula: C6H6+ + C6H2F4 = (C6H6+ • C6H2F4)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr12.0kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + Benzene, 1,2,3,5-tetrafluoro- = (C6H6+ • Benzene, 1,2,3,5-tetrafluoro-)

By formula: C6H6+ + C6H2F4 = (C6H6+ • C6H2F4)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr11.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.1300.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + 1,3,5-Trifluorobenzene = (C6H6+ • 1,3,5-Trifluorobenzene)

By formula: C6H6+ + C6H3F3 = (C6H6+ • C6H3F3)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr12.4kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr28.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + Benzene, 1,2-difluoro- = (C6H6+ • Benzene, 1,2-difluoro-)

By formula: C6H6+ + C6H4F2 = (C6H6+ • C6H4F2)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr15.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.3330.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Benzene, 1,3-difluoro- = (C6H6+ • Benzene, 1,3-difluoro-)

By formula: C6H6+ + C6H4F2 = (C6H6+ • C6H4F2)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr13.9kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr26.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + Benzene, 1,4-difluoro- = (C6H6+ • Benzene, 1,4-difluoro-)

By formula: C6H6+ + C6H4F2 = (C6H6+ • C6H4F2)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr11.3kcal/molMPIErnstberger, Krause, et al., 1990gas phase

C6H6+ + Benzene, fluoro- = (C6H6+ • Benzene, fluoro-)

By formula: C6H6+ + C6H5F = (C6H6+ • C6H5F)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr6.6kcal/molPIRuhl, Bisling, et al., 1986gas phase; from vIP of perpendicular dimer
Δr17.0kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Quantity Value Units Method Reference Comment
Δr30.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase

C6H6+ + Benzene = (C6H6+ • Benzene)

By formula: C6H6+ + C6H6 = (C6H6+ • C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr14. ± 8.kcal/molAVGN/AAverage of 7 out of 10 values; Individual data points
Quantity Value Units Method Reference Comment
Δr28.8cal/mol*KPHPMSHiraoka, Fujimaki, et al., 1991gas phase
Δr27.cal/mol*KPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase
Δr23.cal/mol*KHPMSField, Hamlet, et al., 1969gas phase

(C6H6+ • Benzene) + Benzene = (C6H6+ • 2Benzene)

By formula: (C6H6+ • C6H6) + C6H6 = (C6H6+ • 2C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.8 ± 0.5kcal/molPHPMSHiraoka, Fujimaki, et al., 1991gas phase
Quantity Value Units Method Reference Comment
Δr19.8cal/mol*KPHPMSHiraoka, Fujimaki, et al., 1991gas phase

(C6H6+ • 2Benzene) + Benzene = (C6H6+ • 3Benzene)

By formula: (C6H6+ • 2C6H6) + C6H6 = (C6H6+ • 3C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.0kcal/molPHPMSHiraoka, Fujimaki, et al., 1991gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/AHiraoka, Fujimaki, et al., 1991gas phase; Entropy change calculated or estimated

(C6H6+ • 5Benzene) + Benzene = (C6H6+ • 6Benzene)

By formula: (C6H6+ • 5C6H6) + C6H6 = (C6H6+ • 6C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.5kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 6Benzene) + Benzene = (C6H6+ • 7Benzene)

By formula: (C6H6+ • 6C6H6) + C6H6 = (C6H6+ • 7C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.3kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 7Benzene) + Benzene = (C6H6+ • 8Benzene)

By formula: (C6H6+ • 7C6H6) + C6H6 = (C6H6+ • 8C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.0kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 8Benzene) + Benzene = (C6H6+ • 9Benzene)

By formula: (C6H6+ • 8C6H6) + C6H6 = (C6H6+ • 9C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.9kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 9Benzene) + Benzene = (C6H6+ • 10Benzene)

By formula: (C6H6+ • 9C6H6) + C6H6 = (C6H6+ • 10C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.8kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 10Benzene) + Benzene = (C6H6+ • 11Benzene)

By formula: (C6H6+ • 10C6H6) + C6H6 = (C6H6+ • 11C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr7.8kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 11Benzene) + Benzene = (C6H6+ • 12Benzene)

By formula: (C6H6+ • 11C6H6) + C6H6 = (C6H6+ • 12C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.0kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 12Benzene) + Benzene = (C6H6+ • 13Benzene)

By formula: (C6H6+ • 12C6H6) + C6H6 = (C6H6+ • 13C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.3kcal/molPDissBeck and Hecht, 1991gas phase

(C6H6+ • 13Benzene) + Benzene = (C6H6+ • 14Benzene)

By formula: (C6H6+ • 13C6H6) + C6H6 = (C6H6+ • 14C6H6)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr8.1kcal/molPDissBeck and Hecht, 1991gas phase

C6H6+ + Cyclohexane = (C6H6+ • Cyclohexane)

By formula: C6H6+ + C6H12 = (C6H6+ • C6H12)

Quantity Value Units Method Reference Comment
Δr11.2kcal/molPHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated
Quantity Value Units Method Reference Comment
Δr27.cal/mol*KN/AMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.2295.PHPMSMeot-Ner (Mautner), Hamlet, et al., 1978gas phase; Entropy change calculated or estimated

C6H6+ + Hydrogen chloride = (C6H6+ • Hydrogen chloride)

By formula: C6H6+ + HCl = (C6H6+ • HCl)

Quantity Value Units Method Reference Comment
Δr7.3kcal/molPIWalters, Grover, et al., 1985gas phase

References

Go To: Top, Reaction thermochemistry 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.

Hiraoka, Fujimaki, et al., 1991
Hiraoka, K.; Fujimaki, S.; Aruga, K.; Yamabe, S., Stability and Structure of Benzene Dimer Cation (C6H6)2+, J. Chem. Phys., 1991, 95, 11, 8413, https://doi.org/10.1063/1.461270 . [all data]

Meot-Ner (Mautner), Hamlet, et al., 1978
Meot-Ner (Mautner), M.; Hamlet, P.; Hunter, E.P.; Field, F.H., Bonding Energies in Association Ions of Aromatic Molecules. Correlations with Ionization Energies, J. Am. Chem. Soc., 1978, 100, 17, 5466, https://doi.org/10.1021/ja00485a034 . [all data]

Field, Hamlet, et al., 1969
Field, F.H.; Hamlet, P.; Libby, W.F., Effect of Temperature on the Mass Spectrum of Benzene at High Pressures, J. Am. Chem. Soc., 1969, 91, 11, 2839, https://doi.org/10.1021/ja01039a003 . [all data]

Ruhl, Bisling, et al., 1986
Ruhl, E.; Bisling, P.G.F.; Brutschy, B.; Baumgartel, H., Photoionization of Aromatic van der Waals Complexes in a Supersonic Jet, Chem. Phys. Lett., 1986, 126, 3-4, 232, https://doi.org/10.1016/S0009-2614(86)80075-6 . [all data]

Beck and Hecht, 1991
Beck, S.M.; Hecht, J.H., Photofragmentation of Mass - Selected (C6H6)n+ Clusters: Measurement of Monomer - Cluster Binding Energy for n = 7 - 15, J. Chem. Phys., 1991, 96, 3, 1975, https://doi.org/10.1063/1.462099 . [all data]

Ernstberger, Krause, et al., 1990
Ernstberger, B.; Krause, H.; Kiermeier, A.; Neusser, H.J., Multiphoton ionization and dissociation of mixed van der Waals clusters in a linear reflectron time-of-flight mass spectrometer, J. Chem. Phys., 1990, 92, 9, 5285, https://doi.org/10.1063/1.458603 . [all data]

Walters, Grover, et al., 1985
Walters, E.A.; Grover, J.R.; White, M.G.; Hui, E.T., On the Structure and Thermochemistry of the van der Waals Molecule C6H6.HCl and its Photoion (C6H6.HCl)+, J. Phys. Chem., 1985, 89, 18, 3814, https://doi.org/10.1021/j100264a009 . [all data]


Notes

Go To: Top, Reaction thermochemistry data, Ion clustering data, References