3,4,5-triMe-benzoate anion


Reaction thermochemistry 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 by: John E. Bartmess

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Individual Reactions

C10H11O2- + Hydrogen cation = 3,4,5-Trimethylbenzoic acid

By formula: C10H11O2- + H+ = C10H12O2

Quantity Value Units Method Reference Comment
Δr341.3 ± 2.2kcal/molG+TSDecouzon, Exner, et al., 1996gas phase
Quantity Value Units Method Reference Comment
Δr334.2 ± 2.0kcal/molIMREDecouzon, Exner, et al., 1996gas phase

Gas phase ion energetics 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 by: John E. Bartmess

Electron affinity of neutral species

EAneutral (eV) Method Reference Comment
3.70 ± 0.16D-EADecouzon, Exner, et al., 1996 

Protonation reactions

C10H11O2- + Hydrogen cation = 3,4,5-Trimethylbenzoic acid

By formula: C10H11O2- + H+ = C10H12O2

Quantity Value Units Method Reference Comment
Δr341.3 ± 2.2kcal/molG+TSDecouzon, Exner, et al., 1996gas phase
Quantity Value Units Method Reference Comment
Δr334.2 ± 2.0kcal/molIMREDecouzon, Exner, et al., 1996gas phase

References

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

Decouzon, Exner, et al., 1996
Decouzon, M.; Exner, O.; Gal, J.-F.; Maria, P.-C., Non-classical Buttressing Effect: Gas-phase Ionization of Some Methyl Substituted Benzoic Acids, J. Chem. Soc. Perkin Trans., 1996, 2, 4, 475, https://doi.org/10.1039/p29960000475 . [all data]


Notes

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