pNO2-C6H4CH2O 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

C7H6NO3- + Hydrogen cation = Benzenemethanol, 4-nitro-

By formula: C7H6NO3- + H+ = C7H7NO3

Quantity Value Units Method Reference Comment
Δr356.9 ± 2.1kcal/molG+TSMustanir, Than, et al., 2005gas phase
Quantity Value Units Method Reference Comment
Δr350.3 ± 2.0kcal/molIMREMustanir, Than, et al., 2005gas 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
2.63 ± 0.13D-EAMustanir, Than, et al., 2005 

Protonation reactions

C7H6NO3- + Hydrogen cation = Benzenemethanol, 4-nitro-

By formula: C7H6NO3- + H+ = C7H7NO3

Quantity Value Units Method Reference Comment
Δr356.9 ± 2.1kcal/molG+TSMustanir, Than, et al., 2005gas phase
Quantity Value Units Method Reference Comment
Δr350.3 ± 2.0kcal/molIMREMustanir, Than, et al., 2005gas 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.

Mustanir, Than, et al., 2005
Mustanir; Than, S.; Mishima, M., Substituent effects on the gas phase acidity of phenylacetylenes and benzyl alcohols, Bull. Chem. Soc. Japan, 2005, 78, 1, 147-153, https://doi.org/10.1246/bcsj.78.147 . [all data]


Notes

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