3-aza-5-CO2Me-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

C8H6NO4- + Hydrogen cation = C8H7NO4

By formula: C8H6NO4- + H+ = C8H7NO4

Quantity Value Units Method Reference Comment
Δr1382. ± 21.kJ/molG+TSBroadus and Kass, 2000gas phase
Quantity Value Units Method Reference Comment
Δr1352. ± 21.kJ/molIMRBBroadus and Kass, 2000gas phase

Gas phase ion energetics data

Go To: Top, Reaction thermochemistry data, References, Notes

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

Data compiled by: John E. Bartmess

Electron affinity of neutral species

EAneutral (eV) Method Reference Comment
4.170 ± 0.070LPESWang, Broadus, et al., 2000Vertical Detachment Energy: 4.38±0.06 eV

Protonation reactions

C8H6NO4- + Hydrogen cation = C8H7NO4

By formula: C8H6NO4- + H+ = C8H7NO4

Quantity Value Units Method Reference Comment
Δr1382. ± 21.kJ/molG+TSBroadus and Kass, 2000gas phase
Quantity Value Units Method Reference Comment
Δr1352. ± 21.kJ/molIMRBBroadus and Kass, 2000gas phase

References

Go To: Top, Reaction thermochemistry data, Gas phase ion energetics data, Notes

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

Broadus and Kass, 2000
Broadus, K.M.; Kass, S.R., Probing Electrostatic Effects: Formation and Characterization of Zwitterionic Ions and their Neutral Counterparts in the Gas Phase, J. Am. Chem. Soc., 2000, 122, 37, 9014, https://doi.org/10.1021/ja0016708 . [all data]

Wang, Broadus, et al., 2000
Wang, X.B.; Broadus, K.M.; Wang, L.S.; Kass, S.R., Photodetachment of the first zwitterionic anions in the gas phase: Probing intramolecular Coulomb repulsion and attraction, J. Am. Chem. Soc., 2000, 122, 34, 8305-8306, https://doi.org/10.1021/ja001943z . [all data]


Notes

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