2,4,6-triNO2-C6H2CH2 anion


Reaction thermochemistry data

Go To: Top, Gas phase ion energetics 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

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

C7H4N3O6- + Hydrogen cation = Trinitrotoluene

By formula: C7H4N3O6- + H+ = C7H5N3O6

Quantity Value Units Method Reference Comment
Δr1320. ± 9.2kJ/molG+TSKoppel, Taft, et al., 1994gas phase
Quantity Value Units Method Reference Comment
Δr1293. ± 8.4kJ/molIMREKoppel, Taft, et al., 1994gas phase
Δr1351. ± 21.kJ/molIMRBDzidic, Carroll, et al., 1974gas 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

Protonation reactions

C7H4N3O6- + Hydrogen cation = Trinitrotoluene

By formula: C7H4N3O6- + H+ = C7H5N3O6

Quantity Value Units Method Reference Comment
Δr1320. ± 9.2kJ/molG+TSKoppel, Taft, et al., 1994gas phase
Quantity Value Units Method Reference Comment
Δr1293. ± 8.4kJ/molIMREKoppel, Taft, et al., 1994gas phase
Δr1351. ± 21.kJ/molIMRBDzidic, Carroll, et al., 1974gas 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.

Koppel, Taft, et al., 1994
Koppel, I.A.; Taft, R.W.; Anvia, F.; Zhu, S.Z.; Hu, L.Q.; Sung, K.S.; Desmarteau, D.D.; Yagupolskii, L.M., The Gas-Phase Acidities of Very Strong Neutral Bronsted Acids, J. Am. Chem. Soc., 1994, 116, 7, 3047, https://doi.org/10.1021/ja00086a038 . [all data]

Dzidic, Carroll, et al., 1974
Dzidic, I.; Carroll, D.I.; Stillwell, R.N.; Horning, E.C., Gas phase reactions. Ionization by proton transfer to superoxide anions, J. Am. Chem. Soc., 1974, 96, 5258. [all data]


Notes

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