Bromine anion


Ion clustering data

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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

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Clustering reactions

Bromine anion + Argon = (Bromine anion • Argon)

By formula: Br- + Ar = (Br- • Ar)

Quantity Value Units Method Reference Comment
Δr0.80kcal/molTherZhao, Yourshaw, et al., 1994gas phase; B
Δr1.40kcal/molMoblGatland, 1984gas phase; B,M

Bromine anion + Selenium dibromide = Br3Se-

By formula: Br- + Br2Se = Br3Se-

Quantity Value Units Method Reference Comment
Δr26.3 ± 1.4kcal/molCIDTLobring, Hao, et al., 2003gas phase; B

Bromine anion + Bromine = (Bromine anion • Bromine)

By formula: Br- + Br2 = (Br- • Br2)

Quantity Value Units Method Reference Comment
Δr30.4 ± 1.7kcal/molCIDTNizzi, Pommerening, et al., 1998gas phase; B
Δr33.70kcal/molN/ACheck, Faust, et al., 2001gas phase; Fe-; ; ΔS(EA)=5.8; B
Quantity Value Units Method Reference Comment
Δr22.50kcal/molN/ACheck, Faust, et al., 2001gas phase; Fe-; ; ΔS(EA)=5.8; B

Bromine anion + Phosphorus tribromide = Br4P-

By formula: Br- + Br3P = Br4P-

Quantity Value Units Method Reference Comment
Δr15.5 ± 1.4kcal/molCIDTHeil, Check, et al., 2002gas phase; B

Bromine anion + Bromotrifluoromethane = CBr2F3-

By formula: Br- + CBrF3 = CBr2F3-

Quantity Value Units Method Reference Comment
Δr13.90 ± 0.20kcal/molTDAsBogdanov and McMahon, 2006gas phase; B
Quantity Value Units Method Reference Comment
Δr7.28kcal/molTDAsBogdanov and McMahon, 2006gas phase; B

Bromine anion + Trichloromethane = (Bromine anion • Trichloromethane)

By formula: Br- + CHCl3 = (Br- • CHCl3)

Quantity Value Units Method Reference Comment
Δr15.80kcal/molMoblGiles and Grimsrud, 1993gas phase; B
Quantity Value Units Method Reference Comment
Δr9.50kcal/molMoblGiles and Grimsrud, 1993gas phase; B

Bromine anion + Hydrogen cyanide = (Bromine anion • Hydrogen cyanide)

By formula: Br- + CHN = (Br- • CHN)

Quantity Value Units Method Reference Comment
Δr19.4 ± 1.0kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B,M
Δr16.0 ± 2.0kcal/molEstLarson and McMahon, 1984gas phase; Extrapolated from other halide data; B
Quantity Value Units Method Reference Comment
Δr19.8cal/mol*KPHPMSMeot-ner, Cybulski, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr13.5 ± 1.6kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B

(Bromine anion • Hydrogen cyanide) + Hydrogen cyanide = (Bromine anion • 2Hydrogen cyanide)

By formula: (Br- • CHN) + CHN = (Br- • 2CHN)

Quantity Value Units Method Reference Comment
Δr16.3 ± 1.0kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B,M
Quantity Value Units Method Reference Comment
Δr22.7cal/mol*KPHPMSMeot-ner, Cybulski, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr9.50kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B

(Bromine anion • 2Hydrogen cyanide) + Hydrogen cyanide = (Bromine anion • 3Hydrogen cyanide)

By formula: (Br- • 2CHN) + CHN = (Br- • 3CHN)

Quantity Value Units Method Reference Comment
Δr12.8 ± 1.0kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B,M
Quantity Value Units Method Reference Comment
Δr21.9cal/mol*KPHPMSMeot-ner, Cybulski, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr6.30kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B

(Bromine anion • 3Hydrogen cyanide) + Hydrogen cyanide = (Bromine anion • 4Hydrogen cyanide)

By formula: (Br- • 3CHN) + CHN = (Br- • 4CHN)

Quantity Value Units Method Reference Comment
Δr10.4 ± 1.0kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B,M
Quantity Value Units Method Reference Comment
Δr22.1cal/mol*KPHPMSMeot-ner, Cybulski, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr3.80kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B

(Bromine anion • 4Hydrogen cyanide) + Hydrogen cyanide = (Bromine anion • 5Hydrogen cyanide)

By formula: (Br- • 4CHN) + CHN = (Br- • 5CHN)

Quantity Value Units Method Reference Comment
Δr8.1 ± 1.0kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B,M
Quantity Value Units Method Reference Comment
Δr18.5cal/mol*KPHPMSMeot-ner, Cybulski, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr2.60kcal/molTDAsMeot-ner, Cybulski, et al., 1988gas phase; B

Bromine anion + Formic acid = CH2BrO2-

By formula: Br- + CH2O2 = CH2BrO2-

Quantity Value Units Method Reference Comment
Δr17.2 ± 1.7kcal/molCIDTWalker and Sunderlin, 1999gas phase; B

Bromine anion + Methane, bromo- = (Bromine anion • Methane, bromo-)

By formula: Br- + CH3Br = (Br- • CH3Br)

Quantity Value Units Method Reference Comment
Δr11.2 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr9.20 ± 0.50kcal/molTDAsDougherty and Roberts, 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr14.0cal/mol*KHPMSDougherty and Roberts, 1974gas phase; M
Quantity Value Units Method Reference Comment
Δr4.60 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr5.00 ± 0.80kcal/molTDAsDougherty and Roberts, 1974gas phase; B

Bromine anion + Chloromethane = (Bromine anion • Chloromethane)

By formula: Br- + CH3Cl = (Br- • CH3Cl)

Quantity Value Units Method Reference Comment
Δr10.9 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr4.85 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B

Bromine anion + Methane, nitro- = CH3BrNO2-

By formula: Br- + CH3NO2 = CH3BrNO2-

Quantity Value Units Method Reference Comment
Δr9.6 ± 2.0kcal/molIMRETanabe, Morgon, et al., 1996gas phase; Anchored to H2O..Br- of Hiraoka, Mizure, et al., 19882; B

Bromine anion + Methyl Alcohol = (Bromine anion • Methyl Alcohol)

By formula: Br- + CH4O = (Br- • CH4O)

Quantity Value Units Method Reference Comment
Δr14.50 ± 0.10kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr13.9 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr17.6cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr8.00 ± 0.10kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr8.7 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B
Δr8.4 ± 2.0kcal/molIMRETanabe, Morgon, et al., 1996gas phase; Anchored to H2O..Br- of Hiraoka, Mizure, et al., 19882; B

(Bromine anion • Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 2Methyl Alcohol)

By formula: (Br- • CH4O) + CH4O = (Br- • 2CH4O)

Quantity Value Units Method Reference Comment
Δr12.00 ± 0.20kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr12.5 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr20.7cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr5.62kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr6.3 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B

(Bromine anion • 2Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 3Methyl Alcohol)

By formula: (Br- • 2CH4O) + CH4O = (Br- • 3CH4O)

Quantity Value Units Method Reference Comment
Δr9.50 ± 0.50kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr10.6 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr21.6cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr4.25kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr4.2 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B

(Bromine anion • 3Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 4Methyl Alcohol)

By formula: (Br- • 3CH4O) + CH4O = (Br- • 4CH4O)

Quantity Value Units Method Reference Comment
Δr9.9 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr23.2cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr3.0 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B

(Bromine anion • 4Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 5Methyl Alcohol)

By formula: (Br- • 4CH4O) + CH4O = (Br- • 5CH4O)

Quantity Value Units Method Reference Comment
Δr9.8 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr25.2cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr2.3 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B

(Bromine anion • 5Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 6Methyl Alcohol)

By formula: (Br- • 5CH4O) + CH4O = (Br- • 6CH4O)

Quantity Value Units Method Reference Comment
Δr9.1 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr23.6cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr2.1 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B

(Bromine anion • 6Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 7Methyl Alcohol)

By formula: (Br- • 6CH4O) + CH4O = (Br- • 7CH4O)

Quantity Value Units Method Reference Comment
Δr8.5 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr22.9cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr1.7 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B

(Bromine anion • 7Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 8Methyl Alcohol)

By formula: (Br- • 7CH4O) + CH4O = (Br- • 8CH4O)

Quantity Value Units Method Reference Comment
Δr8.4 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B,M
Quantity Value Units Method Reference Comment
Δr23.1cal/mol*KPHPMSHiraoka and Yamabe, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr1.5 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; B

(Bromine anion • 8Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 9Methyl Alcohol)

By formula: (Br- • 8CH4O) + CH4O = (Br- • 9CH4O)

Quantity Value Units Method Reference Comment
Δr8.2 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; Entropy estimated.; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/AHiraoka and Yamabe, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr1.3 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; Entropy estimated.; B

(Bromine anion • 9Methyl Alcohol) + Methyl Alcohol = (Bromine anion • 10Methyl Alcohol)

By formula: (Br- • 9CH4O) + CH4O = (Br- • 10CH4O)

Quantity Value Units Method Reference Comment
Δr8.0 ± 1.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; Entropy estimated.; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/AHiraoka and Yamabe, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr1.1 ± 2.0kcal/molTDAsHiraoka and Yamabe, 1991gas phase; Entropy estimated.; B

Bromine anion + Methane = CH4Br-

By formula: Br- + CH4 = CH4Br-

Quantity Value Units Method Reference Comment
Δr3.10kcal/molN/AHiraoka, Mizuno, et al., 2001gas phase; B
Quantity Value Units Method Reference Comment
Δr-2.27kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B

Bromine anion + Carbon dioxide = (Bromine anion • Carbon dioxide)

By formula: Br- + CO2 = (Br- • CO2)

Quantity Value Units Method Reference Comment
Δr5.3 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995gas phase; Affinity: shift in apparent EA from lesser-solvated ion. Ignores any neutral-neutral bond.; B
Δr6.7 ± 1.0kcal/molTDAsHiraoka, Mizuse, et al., 1987gas phase; B,M
Quantity Value Units Method Reference Comment
Δr16.5cal/mol*KPHPMSHiraoka, Mizuse, et al., 1987gas phase; M
Quantity Value Units Method Reference Comment
Δr1.8 ± 2.0kcal/molTDAsHiraoka, Mizuse, et al., 1987gas phase; B

(Bromine anion • Carbon dioxide) + Carbon dioxide = (Bromine anion • 2Carbon dioxide)

By formula: (Br- • CO2) + CO2 = (Br- • 2CO2)

Quantity Value Units Method Reference Comment
Δr5.1 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B
Δr6.0 ± 1.0kcal/molTDAsHiraoka, Mizuse, et al., 1987gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.0cal/mol*KPHPMSHiraoka, Mizuse, et al., 1987gas phase; M
Quantity Value Units Method Reference Comment
Δr0.3 ± 2.0kcal/molTDAsHiraoka, Mizuse, et al., 1987gas phase; B

(Bromine anion • 2Carbon dioxide) + Carbon dioxide = (Bromine anion • 3Carbon dioxide)

By formula: (Br- • 2CO2) + CO2 = (Br- • 3CO2)

Quantity Value Units Method Reference Comment
Δr5.1 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 3Carbon dioxide) + Carbon dioxide = (Bromine anion • 4Carbon dioxide)

By formula: (Br- • 3CO2) + CO2 = (Br- • 4CO2)

Quantity Value Units Method Reference Comment
Δr5.2 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 4Carbon dioxide) + Carbon dioxide = (Bromine anion • 5Carbon dioxide)

By formula: (Br- • 4CO2) + CO2 = (Br- • 5CO2)

Quantity Value Units Method Reference Comment
Δr4.2 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 5Carbon dioxide) + Carbon dioxide = (Bromine anion • 6Carbon dioxide)

By formula: (Br- • 5CO2) + CO2 = (Br- • 6CO2)

Quantity Value Units Method Reference Comment
Δr4.0 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 6Carbon dioxide) + Carbon dioxide = (Bromine anion • 7Carbon dioxide)

By formula: (Br- • 6CO2) + CO2 = (Br- • 7CO2)

Quantity Value Units Method Reference Comment
Δr3.6 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 7Carbon dioxide) + Carbon dioxide = (Bromine anion • 8Carbon dioxide)

By formula: (Br- • 7CO2) + CO2 = (Br- • 8CO2)

Quantity Value Units Method Reference Comment
Δr3.7 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 8Carbon dioxide) + Carbon dioxide = (Bromine anion • 9Carbon dioxide)

By formula: (Br- • 8CO2) + CO2 = (Br- • 9CO2)

Quantity Value Units Method Reference Comment
Δr1.8 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 9Carbon dioxide) + Carbon dioxide = (Bromine anion • 10Carbon dioxide)

By formula: (Br- • 9CO2) + CO2 = (Br- • 10CO2)

Quantity Value Units Method Reference Comment
Δr1.8 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

(Bromine anion • 10Carbon dioxide) + Carbon dioxide = (Bromine anion • 11Carbon dioxide)

By formula: (Br- • 10CO2) + CO2 = (Br- • 11CO2)

Quantity Value Units Method Reference Comment
Δr0.5 ± 2.0kcal/molPDisArnold, Bradforth, et al., 1995, 2gas phase; EA given is Vertical Detachment Energy. Affinity: difference between successive EAs in (Y); B

Bromine anion + Carbon disulfide = (Bromine anion • Carbon disulfide)

By formula: Br- + CS2 = (Br- • CS2)

Quantity Value Units Method Reference Comment
Δr8.30 ± 0.20kcal/molTDAsHiraoka, Fujimaki, et al., 1993gas phase; B,M
Quantity Value Units Method Reference Comment
Δr13.0cal/mol*KPHPMSHiraoka, Fujimaki, et al., 1993gas phase; M
Quantity Value Units Method Reference Comment
Δr4.4 ± 1.0kcal/molTDAsHiraoka, Fujimaki, et al., 1993gas phase; B

(Bromine anion • Carbon disulfide) + Carbon disulfide = (Bromine anion • 2Carbon disulfide)

By formula: (Br- • CS2) + CS2 = (Br- • 2CS2)

Quantity Value Units Method Reference Comment
Δr7.30 ± 0.20kcal/molTDAsHiraoka, Fujimaki, et al., 1993gas phase; B,M
Quantity Value Units Method Reference Comment
Δr20.4cal/mol*KPHPMSHiraoka, Fujimaki, et al., 1993gas phase; M
Quantity Value Units Method Reference Comment
Δr1.2 ± 1.0kcal/molTDAsHiraoka, Fujimaki, et al., 1993gas phase; B

Bromine anion + Ethene, tetrafluoro- = C2BrF4-

By formula: Br- + C2F4 = C2BrF4-

Quantity Value Units Method Reference Comment
Δr7.10 ± 0.50kcal/molTDAsHiraoka, Mochizuki, et al., 2008gas phase; The experimental HOF of C2F4 has been questioned as being too positive: Curtiss, Raghavachari, et al., 7374, 11CHA/DEN; B
Quantity Value Units Method Reference Comment
Δr2.33 ± 0.50kcal/molTDAsHiraoka, Mochizuki, et al., 2008gas phase; The experimental HOF of C2F4 has been questioned as being too positive: Curtiss, Raghavachari, et al., 7374, 11CHA/DEN; B

Bromine anion + Acetylene = C2H2Br-

By formula: Br- + C2H2 = C2H2Br-

Quantity Value Units Method Reference Comment
Δr8.60kcal/molLPESWild, Milley, et al., 2000gas phase; Given: 8.635±0.009 kcal/mol(0 K); B

Bromine anion + Acetonitrile = (Bromine anion • Acetonitrile)

By formula: Br- + C2H3N = (Br- • C2H3N)

Quantity Value Units Method Reference Comment
Δr14.3 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr12.10 ± 0.40kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B
Δr12.90 ± 0.40kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr12.9 ± 2.0kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B,M
Δr12.9kcal/molHPMSCaldwell, Masucci, et al., 1989gas phase; M
Quantity Value Units Method Reference Comment
Δr12.2cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr16.5cal/mol*KHPMSYamdagni and Kebarle, 1972gas phase; M
Quantity Value Units Method Reference Comment
Δr8.70 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr8.8 ± 2.0kcal/molIMRETanabe, Morgon, et al., 1996gas phase; Anchored to H2O..Br- of Hiraoka, Mizure, et al., 19882; B
Δr9.20 ± 0.70kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr8.0 ± 2.0kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B

(Bromine anion • Acetonitrile) + Acetonitrile = (Bromine anion • 2Acetonitrile)

By formula: (Br- • C2H3N) + C2H3N = (Br- • 2C2H3N)

Quantity Value Units Method Reference Comment
Δr11.70 ± 0.40kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr11.50 ± 0.70kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B
Δr11.80kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B,M
Quantity Value Units Method Reference Comment
Δr17.0cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr20.4cal/mol*KHPMSYamdagni and Kebarle, 1972gas phase; M
Quantity Value Units Method Reference Comment
Δr6.6 ± 1.3kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr5.80kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B

(Bromine anion • 2Acetonitrile) + Acetonitrile = (Bromine anion • 3Acetonitrile)

By formula: (Br- • 2C2H3N) + C2H3N = (Br- • 3C2H3N)

Quantity Value Units Method Reference Comment
Δr9.20 ± 0.40kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr10.40 ± 0.70kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B
Δr10.00kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B,M
Quantity Value Units Method Reference Comment
Δr16.7cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr21.7cal/mol*KHPMSYamdagni and Kebarle, 1972gas phase; M
Quantity Value Units Method Reference Comment
Δr4.2 ± 1.3kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr3.60kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B

(Bromine anion • 3Acetonitrile) + Acetonitrile = (Bromine anion • 4Acetonitrile)

By formula: (Br- • 3C2H3N) + C2H3N = (Br- • 4C2H3N)

Quantity Value Units Method Reference Comment
Δr8.70 ± 0.30kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr8.50 ± 0.80kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B
Δr5.50kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.6cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr10.9cal/mol*KHPMSYamdagni and Kebarle, 1972gas phase; Entropy change is questionable; M
Quantity Value Units Method Reference Comment
Δr2.8 ± 1.2kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr2.20kcal/molTDAsYamdagni and Kebarle, 1972gas phase; B

(Bromine anion • 4Acetonitrile) + Acetonitrile = (Bromine anion • 5Acetonitrile)

By formula: (Br- • 4C2H3N) + C2H3N = (Br- • 5C2H3N)

Quantity Value Units Method Reference Comment
Δr8.50 ± 0.30kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr5.80 ± 0.90kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr22.2cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr1.8 ± 1.3kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B

(Bromine anion • 5Acetonitrile) + Acetonitrile = (Bromine anion • 6Acetonitrile)

By formula: (Br- • 5C2H3N) + C2H3N = (Br- • 6C2H3N)

Quantity Value Units Method Reference Comment
Δr8.00 ± 0.20kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr5.5 ± 1.0kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr22.5cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr1.20 ± 0.90kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B

(Bromine anion • 6Acetonitrile) + Acetonitrile = (Bromine anion • 7Acetonitrile)

By formula: (Br- • 6C2H3N) + C2H3N = (Br- • 7C2H3N)

Quantity Value Units Method Reference Comment
Δr7.70 ± 0.30kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr3.0 ± 1.1kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr22.9cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr0.8 ± 1.3kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B

(Bromine anion • 7Acetonitrile) + Acetonitrile = (Bromine anion • 8Acetonitrile)

By formula: (Br- • 7C2H3N) + C2H3N = (Br- • 8C2H3N)

Quantity Value Units Method Reference Comment
Δr3.7 ± 1.2kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B

(Bromine anion • 8Acetonitrile) + Acetonitrile = (Bromine anion • 9Acetonitrile)

By formula: (Br- • 8C2H3N) + C2H3N = (Br- • 9C2H3N)

Quantity Value Units Method Reference Comment
Δr2.8 ± 1.4kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B

(Bromine anion • 9Acetonitrile) + Acetonitrile = (Bromine anion • 10Acetonitrile)

By formula: (Br- • 9C2H3N) + C2H3N = (Br- • 10C2H3N)

Quantity Value Units Method Reference Comment
Δr3.5 ± 1.5kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B

(Bromine anion • 10Acetonitrile) + Acetonitrile = (Bromine anion • 11Acetonitrile)

By formula: (Br- • 10C2H3N) + C2H3N = (Br- • 11C2H3N)

Quantity Value Units Method Reference Comment
Δr1.2 ± 1.6kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B

(Bromine anion • 11Acetonitrile) + Acetonitrile = (Bromine anion • 12Acetonitrile)

By formula: (Br- • 11C2H3N) + C2H3N = (Br- • 12C2H3N)

Quantity Value Units Method Reference Comment
Δr1.2 ± 1.7kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B

(Bromine anion • 12Acetonitrile) + Acetonitrile = (Bromine anion • 13Acetonitrile)

By formula: (Br- • 12C2H3N) + C2H3N = (Br- • 13C2H3N)

Quantity Value Units Method Reference Comment
Δr0.5 ± 1.8kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B

(Bromine anion • 13Acetonitrile) + Acetonitrile = (Bromine anion • 14Acetonitrile)

By formula: (Br- • 13C2H3N) + C2H3N = (Br- • 14C2H3N)

Quantity Value Units Method Reference Comment
Δr0.7 ± 1.9kcal/molN/AMarkovich, Perera, et al., 1996gas phase; B

Bromine anion + Ethyl bromide = (Bromine anion • Ethyl bromide)

By formula: Br- + C2H5Br = (Br- • C2H5Br)

Quantity Value Units Method Reference Comment
Δr12.0 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr11.60kcal/molTDAsDougherty, 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.2cal/mol*KHPMSDougherty, 1974gas phase; M
Quantity Value Units Method Reference Comment
Δr5.90 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr5.90kcal/molTDAsDougherty, 1974gas phase; B

Bromine anion + Ethyl Chloride = (Bromine anion • Ethyl Chloride)

By formula: Br- + C2H5Cl = (Br- • C2H5Cl)

Quantity Value Units Method Reference Comment
Δr11.2 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr5.36 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B

Bromine anion + Dimethyl Sulfoxide = (Bromine anion • Dimethyl Sulfoxide)

By formula: Br- + C2H6OS = (Br- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr17.30kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B,M
Δr17.2kcal/molHPMSCaldwell, Masucci, et al., 1989gas phase; M
Quantity Value Units Method Reference Comment
Δr21.4cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr10.90kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B

(Bromine anion • Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Bromine anion • 2Dimethyl Sulfoxide)

By formula: (Br- • C2H6OS) + C2H6OS = (Br- • 2C2H6OS)

Quantity Value Units Method Reference Comment
Δr14.5kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr22.4cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Bromine anion • 2Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Bromine anion • 3Dimethyl Sulfoxide)

By formula: (Br- • 2C2H6OS) + C2H6OS = (Br- • 3C2H6OS)

Quantity Value Units Method Reference Comment
Δr13.6kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr27.5cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

Bromine anion + Ethanol = C2H6BrO-

By formula: Br- + C2H6O = C2H6BrO-

Quantity Value Units Method Reference Comment
Δr14.10 ± 0.20kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr8.20kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr8.8 ± 2.0kcal/molIMRETanabe, Morgon, et al., 1996gas phase; Anchored to H2O..Br- of Hiraoka, Mizure, et al., 19882; B

Bromine anion + 2Ethanol = C4H12BrO2-

By formula: Br- + 2C2H6O = C4H12BrO2-

Quantity Value Units Method Reference Comment
Δr11.50 ± 0.60kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr5.72kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B

Bromine anion + 3Ethanol = C6H18BrO3-

By formula: Br- + 3C2H6O = C6H18BrO3-

Quantity Value Units Method Reference Comment
Δr9.50 ± 0.30kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr4.37kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B

Bromine anion + Propene, hexafluoro- = C3BrF6-

By formula: Br- + C3F6 = C3BrF6-

Quantity Value Units Method Reference Comment
Δr9.90 ± 0.30kcal/molTDAsHiraoka, Takao, et al., 2002gas phase; B
Quantity Value Units Method Reference Comment
Δr4.24 ± 0.30kcal/molTDAsHiraoka, Takao, et al., 2002gas phase; B

Bromine anion + Propane, 2-bromo- = (Bromine anion • Propane, 2-bromo-)

By formula: Br- + C3H7Br = (Br- • C3H7Br)

Quantity Value Units Method Reference Comment
Δr14.2 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr12.20kcal/molTDAsDougherty, 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.9cal/mol*KHPMSDougherty, 1974gas phase; M
Quantity Value Units Method Reference Comment
Δr6.30 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr6.30kcal/molTDAsDougherty, 1974gas phase; B

Bromine anion + Propane, 1-bromo- = (Bromine anion • Propane, 1-bromo-)

By formula: Br- + C3H7Br = (Br- • C3H7Br)

Quantity Value Units Method Reference Comment
Δr11.60kcal/molTDAsDougherty, 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.8cal/mol*KHPMSDougherty, 1974gas phase; M
Quantity Value Units Method Reference Comment
Δr5.70kcal/molTDAsDougherty, 1974gas phase; B

Bromine anion + Propane, 2-chloro- = (Bromine anion • Propane, 2-chloro-)

By formula: Br- + C3H7Cl = (Br- • C3H7Cl)

Quantity Value Units Method Reference Comment
Δr12.4 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr6.26 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B

Bromine anion + n-Propyl chloride = (Bromine anion • n-Propyl chloride)

By formula: Br- + C3H7Cl = (Br- • C3H7Cl)

Quantity Value Units Method Reference Comment
Δr12.1 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr5.96 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B

Bromine anion + Isopropyl Alcohol = C3H8BrO-

By formula: Br- + C3H8O = C3H8BrO-

Quantity Value Units Method Reference Comment
Δr14.40 ± 0.20kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr8.35kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Δr9.2 ± 2.0kcal/molIMRETanabe, Morgon, et al., 1996gas phase; Anchored to H2O..Br- of Hiraoka, Mizure, et al., 19882; B

Bromine anion + 2Isopropyl Alcohol = C6H16BrO2-

By formula: Br- + 2C3H8O = C6H16BrO2-

Quantity Value Units Method Reference Comment
Δr12.30 ± 0.20kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr5.44kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B

Bromine anion + Propane, 1-bromo-2-methyl- = (Bromine anion • Propane, 1-bromo-2-methyl-)

By formula: Br- + C4H9Br = (Br- • C4H9Br)

Quantity Value Units Method Reference Comment
Δr12.90kcal/molTDAsDougherty, 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr21.8cal/mol*KHPMSDougherty, 1974gas phase; M
Quantity Value Units Method Reference Comment
Δr6.40kcal/molTDAsDougherty, 1974gas phase; B

Bromine anion + Propane, 2-bromo-2-methyl- = (Bromine anion • Propane, 2-bromo-2-methyl-)

By formula: Br- + C4H9Br = (Br- • C4H9Br)

Quantity Value Units Method Reference Comment
Δr15.6 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr12.40kcal/molTDAsDougherty, 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.3cal/mol*KHPMSDougherty, 1974gas phase; M
Quantity Value Units Method Reference Comment
Δr7.30 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Δr6.70kcal/molTDAsDougherty, 1974gas phase; B

Bromine anion + Propane, 2-chloro-2-methyl- = (Bromine anion • Propane, 2-chloro-2-methyl-)

By formula: Br- + C4H9Cl = (Br- • C4H9Cl)

Quantity Value Units Method Reference Comment
Δr13.9 ± 1.0kcal/molTDAsLi, Ross, et al., 1996gas phase; B
Quantity Value Units Method Reference Comment
Δr6.60 ± 0.20kcal/molTDAsLi, Ross, et al., 1996gas phase; B

Bromine anion + 2-Propanol, 2-methyl- = C4H10BrO-

By formula: Br- + C4H10O = C4H10BrO-

Quantity Value Units Method Reference Comment
Δr15.80 ± 0.20kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr8.58kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B

Bromine anion + 22-Propanol, 2-methyl- = C8H20BrO2-

By formula: Br- + 2C4H10O = C8H20BrO2-

Quantity Value Units Method Reference Comment
Δr12.90 ± 0.40kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr5.65kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B

Bromine anion + 32-Propanol, 2-methyl- = C12H30BrO3-

By formula: Br- + 3C4H10O = C12H30BrO3-

Quantity Value Units Method Reference Comment
Δr11.60 ± 0.50kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B
Quantity Value Units Method Reference Comment
Δr4.33kcal/molTDAsBogdanov, Peschke, et al., 1999gas phase; B

Bromine anion + Cyclopentene, octafluoro- = C5BrF8-

By formula: Br- + C5F8 = C5BrF8-

Quantity Value Units Method Reference Comment
Δr12.70 ± 0.30kcal/molTDAsHiraoka, Fujita, et al., 1905gas phase; B
Quantity Value Units Method Reference Comment
Δr7.04 ± 0.30kcal/molTDAsHiraoka, Fujita, et al., 1905gas phase; B

Bromine anion + Propane, 1-bromo-2,2-dimethyl- = (Bromine anion • Propane, 1-bromo-2,2-dimethyl-)

By formula: Br- + C5H11Br = (Br- • C5H11Br)

Quantity Value Units Method Reference Comment
Δr14.40kcal/molTDAsDougherty, 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr25.2cal/mol*KHPMSDougherty, 1974gas phase; M
Quantity Value Units Method Reference Comment
Δr6.90kcal/molTDAsDougherty, 1974gas phase; B

Bromine anion + Benzene, hexafluoro- = (Bromine anion • Benzene, hexafluoro-)

By formula: Br- + C6F6 = (Br- • C6F6)

Quantity Value Units Method Reference Comment
Δr13.9 ± 1.0kcal/molTDAsHiraoka, Mizuse, et al., 1987, 2gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.4cal/mol*KPHPMSHiraoka, Mizuse, et al., 1987, 2gas phase; M
Quantity Value Units Method Reference Comment
Δr8.1 ± 1.6kcal/molTDAsHiraoka, Mizuse, et al., 1987, 2gas phase; B

(Bromine anion • Benzene, hexafluoro-) + Benzene, hexafluoro- = (Bromine anion • 2Benzene, hexafluoro-)

By formula: (Br- • C6F6) + C6F6 = (Br- • 2C6F6)

Quantity Value Units Method Reference Comment
Δr12.2kcal/molPHPMSHiraoka, Mizuse, et al., 1987, 2gas phase; M
Quantity Value Units Method Reference Comment
Δr24.3cal/mol*KPHPMSHiraoka, Mizuse, et al., 1987, 2gas phase; M

Bromine anion + Phenol, pentafluoro- = (Bromine anion • Phenol, pentafluoro-)

By formula: Br- + C6HF5O = (Br- • C6HF5O)

Quantity Value Units Method Reference Comment
Δr25.6 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr15.9 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
15.9423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + 1,3,5-Trinitrobenzene = (Bromine anion • 1,3,5-Trinitrobenzene)

By formula: Br- + C6H3N3O6 = (Br- • C6H3N3O6)

Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; 1,3,5-trinitrobenzene, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr13.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
13.1423.PHPMSPaul and Kebarle, 1991gas phase; 1,3,5-trinitrobenzene, Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-chloro-2-nitro- = (Bromine anion • Benzene, 1-chloro-2-nitro-)

By formula: Br- + C6H4ClNO2 = (Br- • C6H4ClNO2)

Quantity Value Units Method Reference Comment
Δr17.1 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr7.7 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.7423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-chloro-4-nitro- = (Bromine anion • Benzene, 1-chloro-4-nitro-)

By formula: Br- + C6H4ClNO2 = (Br- • C6H4ClNO2)

Quantity Value Units Method Reference Comment
Δr16.1 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.7 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.7423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-chloro-3-nitro- = (Bromine anion • Benzene, 1-chloro-3-nitro-)

By formula: Br- + C6H4ClNO2 = (Br- • C6H4ClNO2)

Quantity Value Units Method Reference Comment
Δr17.5 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr8.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
8.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-fluoro-4-nitro- = (Bromine anion • Benzene, 1-fluoro-4-nitro-)

By formula: Br- + C6H4FNO2 = (Br- • C6H4FNO2)

Quantity Value Units Method Reference Comment
Δr15.8 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.4 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.4423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-fluoro-3-nitro- = (Bromine anion • Benzene, 1-fluoro-3-nitro-)

By formula: Br- + C6H4FNO2 = (Br- • C6H4FNO2)

Quantity Value Units Method Reference Comment
Δr17.3 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr7.9 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.9423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-fluoro-2-nitro- = (Bromine anion • Benzene, 1-fluoro-2-nitro-)

By formula: Br- + C6H4FNO2 = (Br- • C6H4FNO2)

Quantity Value Units Method Reference Comment
Δr17.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr8.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
8.2423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1,3-dinitro- = (Bromine anion • Benzene, 1,3-dinitro-)

By formula: Br- + C6H4N2O4 = (Br- • C6H4N2O4)

Quantity Value Units Method Reference Comment
Δr20.3 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr10.9 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
10.9423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1,4-dinitro- = (Bromine anion • Benzene, 1,4-dinitro-)

By formula: Br- + C6H4N2O4 = (Br- • C6H4N2O4)

Quantity Value Units Method Reference Comment
Δr18.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr9.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
9.2423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1,2-dinitro- = (Bromine anion • Benzene, 1,2-dinitro-)

By formula: Br- + C6H4N2O4 = (Br- • C6H4N2O4)

Quantity Value Units Method Reference Comment
Δr21.0 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.6 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
11.6423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 2-chloro- = (Bromine anion • Phenol, 2-chloro-)

By formula: Br- + C6H5ClO = (Br- • C6H5ClO)

Quantity Value Units Method Reference Comment
Δr21.2 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.5 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
11.5423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 4-chloro- = (Bromine anion • Phenol, 4-chloro-)

By formula: Br- + C6H5ClO = (Br- • C6H5ClO)

Quantity Value Units Method Reference Comment
Δr24.4 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr14.7 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
14.7423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Phenol, 3-chloro- = (Bromine anion • Phenol, 3-chloro-)

By formula: Br- + C6H5ClO = (Br- • C6H5ClO)

Quantity Value Units Method Reference Comment
Δr24.1 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr14.4 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
14.4423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzene, chloro- = (Bromine anion • Benzene, chloro-)

By formula: Br- + C6H5Cl = (Br- • C6H5Cl)

Quantity Value Units Method Reference Comment
Δr11.1 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr2.6 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
2.6423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 2-fluoro- = (Bromine anion • Phenol, 2-fluoro-)

By formula: Br- + C6H5FO = (Br- • C6H5FO)

Quantity Value Units Method Reference Comment
Δr20.9 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.2 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
11.2423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 4-fluoro- = (Bromine anion • Phenol, 4-fluoro-)

By formula: Br- + C6H5FO = (Br- • C6H5FO)

Quantity Value Units Method Reference Comment
Δr23.3 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr13.6 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
13.6423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 3-fluoro- = (Bromine anion • Phenol, 3-fluoro-)

By formula: Br- + C6H5FO = (Br- • C6H5FO)

Quantity Value Units Method Reference Comment
Δr23.4 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr13.7 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
13.7423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, fluoro- = (Bromine anion • Benzene, fluoro-)

By formula: Br- + C6H5F = (Br- • C6H5F)

Quantity Value Units Method Reference Comment
Δr10.6 ± 1.6kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr2.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
2.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, nitroso- = (Bromine anion • Benzene, nitroso-)

By formula: Br- + C6H5NO = (Br- • C6H5NO)

Quantity Value Units Method Reference Comment
Δr13.7 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B
Quantity Value Units Method Reference Comment
Δr5.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Bromine anion + Benzene, nitro- = (Bromine anion • Benzene, nitro-)

By formula: Br- + C6H5NO2 = (Br- • C6H5NO2)

Quantity Value Units Method Reference Comment
Δr15.0 ± 1.8kcal/molTDAsPaul and Kebarle, 1991gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr20.2cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.5 ± 1.0kcal/molTDAsPaul and Kebarle, 1991gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.5423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 4-nitro- = (Bromine anion • Phenol, 4-nitro-)

By formula: Br- + C6H5NO3 = (Br- • C6H5NO3)

Quantity Value Units Method Reference Comment
Δr28.4 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr18.7 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
18.7423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Phenol, 3-nitro- = (Bromine anion • Phenol, 3-nitro-)

By formula: Br- + C6H5NO3 = (Br- • C6H5NO3)

Quantity Value Units Method Reference Comment
Δr27.4 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr17.7 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
17.7423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Phenol = (Bromine anion • Phenol)

By formula: Br- + C6H6O = (Br- • C6H6O)

Quantity Value Units Method Reference Comment
Δr20.8 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Δr19.6kcal/molPHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.1 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
11.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
11.1423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene = (Bromine anion • Benzene)

By formula: Br- + C6H6 = (Br- • C6H6)

Quantity Value Units Method Reference Comment
Δr9.0 ± 2.0kcal/molTDAsHiraoka, Mizuse, et al., 1988, 2gas phase; B,M
Quantity Value Units Method Reference Comment
Δr17.0cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988, 2gas phase; M
Δr17.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr2.5 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; B
Δr3.9 ± 2.6kcal/molTDAsHiraoka, Mizuse, et al., 1988, 2gas phase; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
0.0423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 4-amino- = (Bromine anion • Phenol, 4-amino-)

By formula: Br- + C6H7NO = (Br- • C6H7NO)

Quantity Value Units Method Reference Comment
Δr19.5 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr9.8 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
9.8423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 3-amino- = (Bromine anion • Phenol, 3-amino-)

By formula: Br- + C6H7NO = (Br- • C6H7NO)

Quantity Value Units Method Reference Comment
Δr20.3 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr10.6 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
10.6423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Aniline = (Bromine anion • Aniline)

By formula: Br- + C6H7N = (Br- • C6H7N)

Quantity Value Units Method Reference Comment
Δr14.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + 3,5-Dinitrobenzotrifluoride = (Bromine anion • 3,5-Dinitrobenzotrifluoride)

By formula: Br- + C7H3F3N2O4 = (Br- • C7H3F3N2O4)

Quantity Value Units Method Reference Comment
Δr19.8 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; 3,5-dinitrobenzofluoride, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr10.4 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
10.4423.PHPMSPaul and Kebarle, 1991gas phase; 3,5-dinitrobenzofluoride, Entropy change calculated or estimated; M

Bromine anion + Benzonitrile, 3,5-dinitro- = (Bromine anion • Benzonitrile, 3,5-dinitro-)

By formula: Br- + C7H3N3O4 = (Br- • C7H3N3O4)

Quantity Value Units Method Reference Comment
Δr21.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; 3,5-dinitrobenzonitrile, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr12.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
12.2423.PHPMSPaul and Kebarle, 1991gas phase; 3,5-dinitrobenzonitrile, Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-nitro-3-(trifluoromethyl)- = (Bromine anion • Benzene, 1-nitro-3-(trifluoromethyl)-)

By formula: Br- + C7H4F3NO2 = (Br- • C7H4F3NO2)

Quantity Value Units Method Reference Comment
Δr18.5 ± 1.8kcal/molTDAsPaul and Kebarle, 1991gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr22.3cal/mol*KPHPMSPaul and Kebarle, 1991gas phase; M
Quantity Value Units Method Reference Comment
Δr9.1 ± 1.0kcal/molTDAsPaul and Kebarle, 1991gas phase; ΔGaff at 423 K; B

Bromine anion + 2-Nitro-α,α,α-trifluorotoluene = (Bromine anion • 2-Nitro-α,α,α-trifluorotoluene)

By formula: Br- + C7H4F3NO2 = (Br- • C7H4F3NO2)

Quantity Value Units Method Reference Comment
Δr19.2 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr9.8 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
9.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + 4-Nitro-α,α,α-trifluorotoluene = (Bromine anion • 4-Nitro-α,α,α-trifluorotoluene)

By formula: Br- + C7H4F3NO2 = (Br- • C7H4F3NO2)

Quantity Value Units Method Reference Comment
Δr16.4 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr7.0 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.0423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzonitrile, 2-nitro- = (Bromine anion • Benzonitrile, 2-nitro-)

By formula: Br- + C7H4N2O2 = (Br- • C7H4N2O2)

Quantity Value Units Method Reference Comment
Δr20.9 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.5 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
11.5423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzonitrile, 3-nitro- = (Bromine anion • Benzonitrile, 3-nitro-)

By formula: Br- + C7H4N2O2 = (Br- • C7H4N2O2)

Quantity Value Units Method Reference Comment
Δr20.5 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
11.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzonitrile, 4-nitro- = (Bromine anion • Benzonitrile, 4-nitro-)

By formula: Br- + C7H4N2O2 = (Br- • C7H4N2O2)

Quantity Value Units Method Reference Comment
Δr18.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr9.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
9.2423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, (trichloromethyl)- = (Bromine anion • Benzene, (trichloromethyl)-)

By formula: Br- + C7H5Cl3 = (Br- • C7H5Cl3)

Quantity Value Units Method Reference Comment
Δr12.4 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr3.9 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.9423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 3-(trifluoromethyl)- = (Bromine anion • Phenol, 3-(trifluoromethyl)-)

By formula: Br- + C7H5F3O = (Br- • C7H5F3O)

Quantity Value Units Method Reference Comment
Δr25.7 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B
Δr12.6kcal/molPHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr16.0 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
4.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + 4-(Trifluoromethyl)-phenol = (Bromine anion • 4-(Trifluoromethyl)-phenol)

By formula: Br- + CF3C6H4OH = (Br- • CF3C6H4OH)

Quantity Value Units Method Reference Comment
Δr26.6 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr16.9 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
16.9423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Phenol, 2-(trifluoromethyl)- = (Bromine anion • Phenol, 2-(trifluoromethyl)-)

By formula: Br- + C7H5F3O = (Br- • C7H5F3O)

Quantity Value Units Method Reference Comment
Δr24.1kcal/molPHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
14.4423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzene, (trifluoromethyl)- = (Bromine anion • Benzene, (trifluoromethyl)-)

By formula: Br- + C7H5F3 = (Br- • C7H5F3)

Quantity Value Units Method Reference Comment
Δr12.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B
Δr25.7kcal/molPHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr4.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
16.0423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzonitrile, 2-hydroxy- = (Bromine anion • Benzonitrile, 2-hydroxy-)

By formula: Br- + C7H5NO = (Br- • C7H5NO)

Quantity Value Units Method Reference Comment
Δr27.0 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr17.3 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
17.3423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzonitrile, 4-hydroxy- = (Bromine anion • Benzonitrile, 4-hydroxy-)

By formula: Br- + C7H5NO = (Br- • C7H5NO)

Quantity Value Units Method Reference Comment
Δr27.8 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr18.1 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
18.1423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzonitrile, 3-hydroxy- = (Bromine anion • Benzonitrile, 3-hydroxy-)

By formula: Br- + C7H5NO = (Br- • C7H5NO)

Quantity Value Units Method Reference Comment
Δr27.4 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr17.7 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
17.7423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzaldehyde, 3-nitro- = (Bromine anion • Benzaldehyde, 3-nitro-)

By formula: Br- + C7H5NO3 = (Br- • C7H5NO3)

Quantity Value Units Method Reference Comment
Δr19.7 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr10.3 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
10.3423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzaldehyde, 2-nitro- = (Bromine anion • Benzaldehyde, 2-nitro-)

By formula: Br- + C7H5NO3 = (Br- • C7H5NO3)

Quantity Value Units Method Reference Comment
Δr18.5 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr9.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
9.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzonitrile = (Bromine anion • Benzonitrile)

By formula: Br- + C7H5N = (Br- • C7H5N)

Quantity Value Units Method Reference Comment
Δr14.7 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.2423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzaldehyde = (Bromine anion • Benzaldehyde)

By formula: Br- + C7H6O = (Br- • C7H6O)

Quantity Value Units Method Reference Comment
Δr13.2kcal/molPHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
4.7423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzoic acid = (Bromine anion • Benzoic acid)

By formula: Br- + C7H6O2 = (Br- • C7H6O2)

Quantity Value Units Method Reference Comment
Δr18.3 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr9.8 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
9.8423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzaldehyde, 3-hydroxy- = (Bromine anion • Benzaldehyde, 3-hydroxy-)

By formula: Br- + C7H6O2 = (Br- • C7H6O2)

Quantity Value Units Method Reference Comment
Δr25.2 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr15.5 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
15.5423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzaldehyde, 4-hydroxy- = (Bromine anion • Benzaldehyde, 4-hydroxy-)

By formula: Br- + C7H6O2 = (Br- • C7H6O2)

Quantity Value Units Method Reference Comment
Δr25.8 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr16.1 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
15.4423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M
16.1423.PHPMSPaul and Kebarle, 1990gas phase; switching reaction,Thermochemical ladder(Br-)C6H5OH, Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-methyl-2-nitro- = (Bromine anion • Benzene, 1-methyl-2-nitro-)

By formula: Br- + C7H7NO2 = (Br- • C7H7NO2)

Quantity Value Units Method Reference Comment
Δr15.5 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-methyl-3-nitro- = (Bromine anion • Benzene, 1-methyl-3-nitro-)

By formula: Br- + C7H7NO2 = (Br- • C7H7NO2)

Quantity Value Units Method Reference Comment
Δr15.9 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.5 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Benzene, 1-methyl-4-nitro- = (Bromine anion • Benzene, 1-methyl-4-nitro-)

By formula: Br- + C7H7NO2 = (Br- • C7H7NO2)

Quantity Value Units Method Reference Comment
Δr16.2 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr6.8 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.8423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 2-methyl- = (Bromine anion • Phenol, 2-methyl-)

By formula: Br- + C7H8O = (Br- • C7H8O)

Quantity Value Units Method Reference Comment
Δr20.6 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr10.9 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
10.9423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Anisole = (Bromine anion • Anisole)

By formula: Br- + C7H8O = (Br- • C7H8O)

Quantity Value Units Method Reference Comment
Δr11.8 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr3.3 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.3423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + p-Cresol = (Bromine anion • p-Cresol)

By formula: Br- + C7H8O = (Br- • C7H8O)

Quantity Value Units Method Reference Comment
Δr20.3 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr10.6 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
10.6423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Phenol, 3-methyl- = (Bromine anion • Phenol, 3-methyl-)

By formula: Br- + C7H8O = (Br- • C7H8O)

Quantity Value Units Method Reference Comment
Δr20.6 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr10.9 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
10.9423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + m-Guaiacol = (Bromine anion • m-Guaiacol)

By formula: Br- + C7H8O2 = (Br- • C7H8O2)

Quantity Value Units Method Reference Comment
Δr22.1 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr12.4 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
12.4423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Mequinol = (Bromine anion • Mequinol)

By formula: Br- + C7H8O2 = (Br- • C7H8O2)

Quantity Value Units Method Reference Comment
Δr21.0 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B,M
Quantity Value Units Method Reference Comment
Δr23.cal/mol*KN/APaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.3 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
11.3423.PHPMSPaul and Kebarle, 1990gas phase; Entropy change calculated or estimated; M

Bromine anion + Toluene = (Bromine anion • Toluene)

By formula: Br- + C7H8 = (Br- • C7H8)

Quantity Value Units Method Reference Comment
Δr8.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr0.1 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
0.1423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + 3,5-Bis(trifluoromethyl)nitrobenzene = (Bromine anion • 3,5-Bis(trifluoromethyl)nitrobenzene)

By formula: Br- + C8H3F6NO2 = (Br- • C8H3F6NO2)

Quantity Value Units Method Reference Comment
Δr17.6 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B,M
Quantity Value Units Method Reference Comment
Δr22.cal/mol*KN/APaul and Kebarle, 1991gas phase; 3,5-(CF3)-nitrobenzene, Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr8.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff at 423 K, ΔSaff taken as that of mCF3-nitrobenzene..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
8.2423.PHPMSPaul and Kebarle, 1991gas phase; 3,5-(CF3)-nitrobenzene, Entropy change calculated or estimated; M

Bromine anion + Acetophenone = (Bromine anion • Acetophenone)

By formula: Br- + C8H8O = (Br- • C8H8O)

Quantity Value Units Method Reference Comment
Δr14.1 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr5.6 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
5.6423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

Bromine anion + Acetophenone, 4'-hydroxy- = (Bromine anion • Acetophenone, 4'-hydroxy-)

By formula: Br- + C8H8O2 = (Br- • C8H8O2)

Quantity Value Units Method Reference Comment
Δr25.1 ± 1.8kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B
Quantity Value Units Method Reference Comment
Δr15.4 ± 1.0kcal/molIMREPaul and Kebarle, 1990gas phase; ΔGaff at 423 K; B

Bromine anion + Benzenamine, N,N-dimethyl- = (Bromine anion • Benzenamine, N,N-dimethyl-)

By formula: Br- + C8H11N = (Br- • C8H11N)

Quantity Value Units Method Reference Comment
Δr11.7 ± 1.8kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B,M
Quantity Value Units Method Reference Comment
Δr20.cal/mol*KN/APaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr3.2 ± 1.0kcal/molIMREPaul and Kebarle, 1991gas phase; ΔGaff measured at 303 K, corrected to 423 K, ΔSaff taken as that of PhNO2..Br-; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
3.2423.PHPMSPaul and Kebarle, 1991gas phase; Entropy change calculated or estimated; M

(Bromine anion • 4294967295Cesium) + Cesium = Bromine anion

By formula: (Br- • 4294967295Cs) + Cs = Br-

Quantity Value Units Method Reference Comment
Δr29.80 ± 0.96kcal/molN/AMiller, Leopold, et al., 1986gas phase; Extrapolated by polarizability and radius from experimental data.; B

Bromine anion + Hydrogen bromide = (Bromine anion • Hydrogen bromide)

By formula: Br- + HBr = (Br- • HBr)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr20.6 ± 2.0kcal/molTDAsCaldwell and Kebarle, 1985gas phase; B,M
Δr17.5kcal/molFADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle,switching reaction(Br-/NO3-HNO3/HBr); DG>, ΔrH>; M
Quantity Value Units Method Reference Comment
Δr22.3cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; M
Δr22.cal/mol*KFADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle,switching reaction(Br-/NO3-HNO3/HBr); DG>, ΔrH>; M
Quantity Value Units Method Reference Comment
Δr13.9 ± 2.6kcal/molTDAsCaldwell and Kebarle, 1985gas phase; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
9.4367.FADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle,switching reaction(Br-/NO3-HNO3/HBr); DG>, ΔrH>; M

(Bromine anion • Hydrogen bromide) + Hydrogen bromide = (Bromine anion • 2Hydrogen bromide)

By formula: (Br- • HBr) + HBr = (Br- • 2HBr)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr11.0kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr17.0cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; M

(Bromine anion • Hydrogen bromide) + Sulfur dioxide = (Bromine anion • Sulfur dioxide • Hydrogen bromide)

By formula: (Br- • HBr) + O2S = (Br- • O2S • HBr)

Quantity Value Units Method Reference Comment
Δr10.9kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr18.9cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; M

Bromine anion + Hydrogen chloride = (Bromine anion • Hydrogen chloride)

By formula: Br- + HCl = (Br- • HCl)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr19.6 ± 2.0kcal/molTDEqCaldwell and Kebarle, 1985gas phase; B,M
Quantity Value Units Method Reference Comment
Δr22.0cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; switching reaction(Br-)SO2; M
Quantity Value Units Method Reference Comment
Δr13.0 ± 2.6kcal/molTDEqCaldwell and Kebarle, 1985gas phase; B

(Bromine anion • Hydrogen chloride) + Hydrogen chloride = (Bromine anion • 2Hydrogen chloride)

By formula: (Br- • HCl) + HCl = (Br- • 2HCl)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr12.5kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; switching reaction(Br-)SO2; M
Quantity Value Units Method Reference Comment
Δr18.4cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; switching reaction(Br-)SO2; M

(Bromine anion • Hydrogen chloride) + Sulfur dioxide = (Bromine anion • Sulfur dioxide • Hydrogen chloride)

By formula: (Br- • HCl) + O2S = (Br- • O2S • HCl)

Quantity Value Units Method Reference Comment
Δr12.1kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr18.6cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; M

Bromine anion + hydrogen fluoride = (Bromine anion • hydrogen fluoride)

By formula: Br- + HF = (Br- • HF)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr17.0 ± 2.0kcal/molEstLarson and McMahon, 1984gas phase; Extrapolated from other bihalide data; B
Δr17.0kcal/molHPMSCaldwell, Masucci, et al., 1989gas phase; M

Bromine anion + Nitric acid = (Bromine anion • Nitric acid)

By formula: Br- + HNO3 = (Br- • HNO3)

Quantity Value Units Method Reference Comment
Δr20.0kcal/molFADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle,switching reaction(Br-/NO3-HNO3/HBr), ΔrH>; M
Quantity Value Units Method Reference Comment
Δr18.5cal/mol*KFADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle,switching reaction(Br-/NO3-HNO3/HBr), ΔrH>; M

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
13.4367.FADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle,switching reaction(Br-/NO3-HNO3/HBr), ΔrH>; M

(Bromine anion • Nitric acid) + Nitric acid = (Bromine anion • 2Nitric acid)

By formula: (Br- • HNO3) + HNO3 = (Br- • 2HNO3)

Quantity Value Units Method Reference Comment
Δr18.1kcal/molFADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle(Br-/NO3- - HNO3/HBr), Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr23.6cal/mol*KN/ADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle(Br-/NO3- - HNO3/HBr), Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr11.1kcal/molFADavidson, Fehsenfeld, et al., 1977gas phase; From thermochemical cycle(Br-/NO3- - HNO3/HBr), Entropy change calculated or estimated; M

Bromine anion + Water = (Bromine anion • Water)

By formula: Br- + H2O = (Br- • H2O)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr12.70kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B
Δr11.70 ± 0.40kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr12.60kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B,M
Δr12.7kcal/molHPMSCaldwell, Masucci, et al., 1989gas phase; M
Quantity Value Units Method Reference Comment
Δr14.7cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr18.4cal/mol*KHPMSArshadi, Yamdagni, et al., 1970gas phase; M
Δr19.8cal/mol*KMSBurdett and Hayhurst, 1982gas phase; FLAME SOURCE, 1600 K; M
Quantity Value Units Method Reference Comment
Δr7.30 ± 0.80kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr7.0 ± 2.8kcal/molTDAsBurdett and Hayhurst, 1982gas phase; B
Δr7.0 ± 2.0kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B

(Bromine anion • Water) + Water = (Bromine anion • 2Water)

By formula: (Br- • H2O) + H2O = (Br- • 2H2O)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr11.60 ± 0.30kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr12.20kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B
Δr12.3 ± 1.0kcal/molTDAsPayzant, Yamdagni, et al., 1971gas phase; B
Δr12.3 ± 1.0kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B,M
Quantity Value Units Method Reference Comment
Δr18.0cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr22.9cal/mol*KHPMSArshadi, Yamdagni, et al., 1970gas phase; M
Quantity Value Units Method Reference Comment
Δr6.2 ± 1.0kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr5.4 ± 1.4kcal/molTDAsPayzant, Yamdagni, et al., 1971gas phase; B
Δr5.40kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B
Δr5.7 ± 2.0kcal/molTDAsKebarle, Arshadi, et al., 1968gas phase; B,M

(Bromine anion • 2Water) + Water = (Bromine anion • 3Water)

By formula: (Br- • 2H2O) + H2O = (Br- • 3H2O)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr11.40 ± 0.30kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr6.90kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B
Δr11.5 ± 1.0kcal/molTDAsPayzant, Yamdagni, et al., 1971gas phase; B
Δr11.5 ± 1.0kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B,M
Quantity Value Units Method Reference Comment
Δr22.5cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr24.8cal/mol*KHPMSArshadi, Yamdagni, et al., 1970gas phase; M
Quantity Value Units Method Reference Comment
Δr4.7 ± 1.1kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr4.1 ± 1.4kcal/molTDAsPayzant, Yamdagni, et al., 1971gas phase; B
Δr4.10kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B
Δr4.4 ± 2.0kcal/molTDAsKebarle, Arshadi, et al., 1968gas phase; B,M

(Bromine anion • 3Water) + Water = (Bromine anion • 4Water)

By formula: (Br- • 3H2O) + H2O = (Br- • 4H2O)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr11.00 ± 0.20kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr6.2 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B
Δr10.9 ± 1.0kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B,M
Quantity Value Units Method Reference Comment
Δr26.2cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Δr26.8cal/mol*KHPMSArshadi, Yamdagni, et al., 1970gas phase; M
Quantity Value Units Method Reference Comment
Δr3.10 ± 0.70kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B
Δr2.90kcal/molTDAsArshadi, Yamdagni, et al., 1970gas phase; B
Δr3.3 ± 2.0kcal/molTDAsKebarle, Arshadi, et al., 1968gas phase; B,M

(Bromine anion • 4Water) + Water = (Bromine anion • 5Water)

By formula: (Br- • 4H2O) + H2O = (Br- • 5H2O)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr10.80 ± 0.30kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr6.2 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B
Quantity Value Units Method Reference Comment
Δr28.4cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr2.3 ± 1.2kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B

(Bromine anion • 5Water) + Water = (Bromine anion • 6Water)

By formula: (Br- • 5H2O) + H2O = (Br- • 6H2O)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr10.30 ± 0.50kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B,M
Δr6.0 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B
Quantity Value Units Method Reference Comment
Δr28.2cal/mol*KPHPMSHiraoka, Mizuse, et al., 1988gas phase; M
Quantity Value Units Method Reference Comment
Δr1.8 ± 2.1kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; B

(Bromine anion • 6Water) + Water = (Bromine anion • 7Water)

By formula: (Br- • 6H2O) + H2O = (Br- • 7H2O)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr10.00kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; Entropy estimated; B,M
Δr2.5 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; B
Quantity Value Units Method Reference Comment
Δr29.cal/mol*KN/AHiraoka, Mizuse, et al., 1988gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr1.30kcal/molTDAsHiraoka, Mizuse, et al., 1988gas phase; Entropy estimated; B

(Bromine anion • 7Water) + Water = (Bromine anion • 8Water)

By formula: (Br- • 7H2O) + H2O = (Br- • 8H2O)

Quantity Value Units Method Reference Comment
Δr1.6 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 8Water) + Water = (Bromine anion • 9Water)

By formula: (Br- • 8H2O) + H2O = (Br- • 9H2O)

Quantity Value Units Method Reference Comment
Δr0.7 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 9Water) + Water = (Bromine anion • 10Water)

By formula: (Br- • 9H2O) + H2O = (Br- • 10H2O)

Quantity Value Units Method Reference Comment
Δr1.6 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 10Water) + Water = (Bromine anion • 11Water)

By formula: (Br- • 10H2O) + H2O = (Br- • 11H2O)

Quantity Value Units Method Reference Comment
Δr1.6 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 11Water) + Water = (Bromine anion • 12Water)

By formula: (Br- • 11H2O) + H2O = (Br- • 12H2O)

Quantity Value Units Method Reference Comment
Δr2.5 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 12Water) + Water = (Bromine anion • 13Water)

By formula: (Br- • 12H2O) + H2O = (Br- • 13H2O)

Quantity Value Units Method Reference Comment
Δr1.8 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 13Water) + Water = (Bromine anion • 14Water)

By formula: (Br- • 13H2O) + H2O = (Br- • 14H2O)

Quantity Value Units Method Reference Comment
Δr3.2 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 14Water) + Water = (Bromine anion • 15Water)

By formula: (Br- • 14H2O) + H2O = (Br- • 15H2O)

Quantity Value Units Method Reference Comment
Δr-0.5 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

(Bromine anion • 15Water) + Water = (Bromine anion • 16Water)

By formula: (Br- • 15H2O) + H2O = (Br- • 16H2O)

Quantity Value Units Method Reference Comment
Δr2.3 ± 2.3kcal/molN/AMarkovich, Pollack, et al., 1994gas phase; For photodissociation plus electron loss. Affinity is difference from lower solvated ion.; B

Bromine anion + Ammonia = (Bromine anion • Ammonia)

By formula: Br- + H3N = (Br- • H3N)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr7.70 ± 0.10kcal/molTDAsEvans, Keesee, et al., 1987gas phase; B,M
Quantity Value Units Method Reference Comment
Δr19.1cal/mol*KHPMSEvans, Keesee, et al., 1987gas phase; M
Quantity Value Units Method Reference Comment
Δr2.00 ± 0.20kcal/molTDAsEvans, Keesee, et al., 1987gas phase; B

Bromine anion + Krypton = (Bromine anion • Krypton)

By formula: Br- + Kr = (Br- • Kr)

Quantity Value Units Method Reference Comment
Δr1.10 ± 0.10kcal/molLPESYourshaw, Lenzer, et al., 1998gas phase; given: 0.0795(.001) eV; B
Δr<2.70kcal/molTDAsWada, Kikkawa, et al., 2007gas phase; B
Δr2.00kcal/molMoblGatland, 1984gas phase; B,M

Bromine anion + Nitrous oxide = (Bromine anion • Nitrous oxide)

By formula: Br- + N2O = (Br- • N2O)

Quantity Value Units Method Reference Comment
Δr5.6 ± 0.3kcal/molPHPMSHiraoka, Aruga, et al., 1993gas phase; M
Quantity Value Units Method Reference Comment
Δr18.1cal/mol*KPHPMSHiraoka, Aruga, et al., 1993gas phase; M

(Bromine anion • Nitrous oxide) + Nitrous oxide = (Bromine anion • 2Nitrous oxide)

By formula: (Br- • N2O) + N2O = (Br- • 2N2O)

Quantity Value Units Method Reference Comment
Δr5.4 ± 0.3kcal/molPHPMSHiraoka, Aruga, et al., 1993gas phase; M
Quantity Value Units Method Reference Comment
Δr21.8cal/mol*KPHPMSHiraoka, Aruga, et al., 1993gas phase; M

(Bromine anion • 2Nitrous oxide) + Nitrous oxide = (Bromine anion • 3Nitrous oxide)

By formula: (Br- • 2N2O) + N2O = (Br- • 3N2O)

Quantity Value Units Method Reference Comment
Δr5.0 ± 0.3kcal/molPHPMSHiraoka, Aruga, et al., 1993gas phase; M
Quantity Value Units Method Reference Comment
Δr22.9cal/mol*KPHPMSHiraoka, Aruga, et al., 1993gas phase; M

Bromine anion + Sulfur dioxide = (Bromine anion • Sulfur dioxide)

By formula: Br- + O2S = (Br- • O2S)

Quantity Value Units Method Reference Comment
Δr19.3 ± 2.0kcal/molTDAsCaldwell and Kebarle, 1985gas phase; B,M
Quantity Value Units Method Reference Comment
Δr22.0cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr12.7 ± 2.6kcal/molTDAsCaldwell and Kebarle, 1985gas phase; B

(Bromine anion • Sulfur dioxide) + Hydrogen bromide = (Bromine anion • Hydrogen bromide • Sulfur dioxide)

By formula: (Br- • O2S) + HBr = (Br- • HBr • O2S)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr12.2kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; From thermochemical cycle,switching reaction(Br- HBr)SO2; M
Quantity Value Units Method Reference Comment
Δr19.2cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; From thermochemical cycle,switching reaction(Br- HBr)SO2; M

(Bromine anion • Sulfur dioxide) + Hydrogen chloride = (Bromine anion • Hydrogen chloride • Sulfur dioxide)

By formula: (Br- • O2S) + HCl = (Br- • HCl • O2S)

Bond type: Hydrogen bond (negative ion to hydride)

Quantity Value Units Method Reference Comment
Δr22.4kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; From thermochemical cycle,switching reaction(Br-)SO2; M
Quantity Value Units Method Reference Comment
Δr18.6cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; From thermochemical cycle,switching reaction(Br-)SO2; M

(Bromine anion • Sulfur dioxide) + Sulfur dioxide = (Bromine anion • 2Sulfur dioxide)

By formula: (Br- • O2S) + O2S = (Br- • 2O2S)

Quantity Value Units Method Reference Comment
Δr11.2kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr18.7cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; M

(Bromine anion • 2Sulfur dioxide) + Sulfur dioxide = (Bromine anion • 3Sulfur dioxide)

By formula: (Br- • 2O2S) + O2S = (Br- • 3O2S)

Quantity Value Units Method Reference Comment
Δr8.5kcal/molPHPMSCaldwell and Kebarle, 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr13.8cal/mol*KPHPMSCaldwell and Kebarle, 1985gas phase; M

Bromine anion + sulphur trioxide = BrO3S-

By formula: Br- + O3S = BrO3S-

Quantity Value Units Method Reference Comment
Δr42.8 ± 2.6kcal/molCIDTHao, Gilbert, et al., 2006gas phase; B

(Bromine anion • 4294967295rubidium) + rubidium = Bromine anion

By formula: (Br- • 4294967295Rb) + Rb = Br-

Quantity Value Units Method Reference Comment
Δr26.6 ± 1.0kcal/molTherMiller, Leopold, et al., 1986gas phase; Extrapolated by polarizability and radius from experimental data.; B

Bromine anion + Xenon = (Bromine anion • Xenon)

By formula: Br- + Xe = (Br- • Xe)

Quantity Value Units Method Reference Comment
Δr3.60 ± 0.30kcal/molTDAsWada, Kikkawa, et al., 2007gas phase; B
Δr2.90 ± 0.10kcal/molLPESYourshaw, Lenzer, et al., 1998gas phase; Given: 0.12692(.0005) eV; B
Δr3.40kcal/molMoblGatland, 1984gas phase; B,M
Quantity Value Units Method Reference Comment
Δr-1.17 ± 0.30kcal/molTDAsWada, Kikkawa, et al., 2007gas phase; B

References

Go To: Top, Ion clustering data, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Zhao, Yourshaw, et al., 1994
Zhao, Y.X.; Yourshaw, I.; Reiser, G.; Arnold, C.C.; Neumark, D.M., Study of the ArBr(-), ArI(-), and KrI(-) anions and the corresponding neutral van der Waals complexes by anion zero electron kinetic energy, J. Chem. Phys., 1994, 101, 8, 6538, https://doi.org/10.1063/1.468500 . [all data]

Gatland, 1984
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Lobring, Hao, et al., 2003
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Check, Faust, et al., 2001
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Heil, Check, et al., 2002
Heil, T.E.; Check, C.E.; Lobring, K.C.; Sunderlin, L.S., The thermochemistry of phosphorus tetrahalide anions, J. Phys. Chem. A, 2002, 106, 42, 10043-10048, https://doi.org/10.1021/jp021386y . [all data]

Bogdanov and McMahon, 2006
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Giles and Grimsrud, 1993
Giles, K.; Grimsrud, E.P., Measurements of Equilibria and Reactivity of Cluster Ions at Atmospheric Pressure - Reactions of Cl-(CHCl3)0-2 with CH3Br and CH3I, J. Phys. Chem., 1993, 97, 7, 1318, https://doi.org/10.1021/j100109a012 . [all data]

Meot-ner, Cybulski, et al., 1988
Meot-ner, M.; Cybulski, S.M.; Scheiner, S.; Liebman, J.F., Is CN- Significantly Anisotropic? Comparison of CN- vs. Cl-: Clustering with HCN and Condensed Phase Thermochemistry, J. Phys. Chem., 1988, 92, 10, 2738, https://doi.org/10.1021/j100321a009 . [all data]

Larson and McMahon, 1984
Larson, J.W.; McMahon, T.B., Gas phase bihalide and pseudohalide ions. An ICR determination of hydrogen bond energies in XHY- species (X,Y = F, Cl, Br, CN), Inorg. Chem., 1984, 23, 2029. [all data]

Walker and Sunderlin, 1999
Walker, B.W.; Sunderlin, L.S., The thermochemistry of formic acid halide anion clusters, Int. J. Mass Spectrom., 1999, 184, 2-3, 183-189, https://doi.org/10.1016/S1387-3806(99)00008-1 . [all data]

Li, Ross, et al., 1996
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Tanabe, Morgon, et al., 1996
Tanabe, F.K.J.; Morgon, N.H.; Riveros, J.M., Relative Bromide and Iodide Affinity of Simple Solvent Molecules Determined by FT-ICR, J. Phys. Chem., 1996, 100, 8, 2862-2866, https://doi.org/10.1021/jp952290p . [all data]

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Hiraoka, K.; Mizure, S.; Yamabe, S.; Nakatsuji, Y., Gas Phase Clustering Reactions of CN- and CH2CN- with MeCN, Chem. Phys. Lett., 1988, 148, 6, 497, https://doi.org/10.1016/0009-2614(88)80320-8 . [all data]

Bogdanov, Peschke, et al., 1999
Bogdanov, B.; Peschke, M.; Tonner, D.S.; Szulejko, J.E.; McMahon, T.B., Stepwise solvation of halides by alcohol molecules in the gas phase, Int. J. Mass Spectrom., 1999, 187, 707-725, https://doi.org/10.1016/S1387-3806(98)14180-5 . [all data]

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Hiraoka, K.; Yamabe, S., Solvation of Halide Ions with CH3OH in the gas Phase, Int. J. Mass Spectrom. Ion Proc., 1991, 109, 133, https://doi.org/10.1016/0168-1176(91)85101-Q . [all data]

Hiraoka, Mizuno, et al., 2001
Hiraoka, K.; Mizuno, T.; Iino, T.; Eguchi, D.; Yamabe, S., Characteristic changes of bond energies for gas-phase cluster ions of halide ions with methane and chloromethanes, J. Phys. Chem. A, 2001, 105, 20, 4887-4893, https://doi.org/10.1021/jp010143n . [all data]

Arnold, Bradforth, et al., 1995
Arnold, D.W.; Bradforth, S.E.; Kim, E.H.; Neumark, D.M., Study of halogen carbon dioxide clusters and the fluoroformyloxyl radical by photodetachment of X(-)(CO2) (X=I,Cl,Br) and FCO2-, J. Chem. Phys., 1995, 102, 9, 3493, https://doi.org/10.1063/1.468575 . [all data]

Hiraoka, Mizuse, et al., 1987
Hiraoka, K.; Mizuse, S.; Yamabe, S., Stability and Structure of Cluster Ions: Halide Ions with CO2, J. Chem. Phys., 1987, 87, 6, 3647, https://doi.org/10.1063/1.452962 . [all data]

Arnold, Bradforth, et al., 1995, 2
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Notes

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