nPnCH(Et)CO2 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

C8H17O2- + Hydrogen cation = Heptanoic acid, 2-ethyl-

By formula: C8H17O2- + H+ = C9H18O2

Quantity Value Units Method Reference Comment
Δr338.4 ± 2.0kcal/molTDEqNorrman and McMahon, 1999gas phase; folded form. dSacid = 11.2 eu
Δr345.7 ± 2.0kcal/molTDEqNorrman and McMahon, 1999gas phase; Unfolded form
Quantity Value Units Method Reference Comment
Δr335.1 ± 2.1kcal/molH-TSNorrman and McMahon, 1999gas phase; folded form. dSacid = 11.2 eu
Δr337.4 ± 2.1kcal/molH-TSNorrman and McMahon, 1999gas phase; Unfolded form

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.

Norrman and McMahon, 1999
Norrman, K.; McMahon, T.B., Intramolecular solvation of carboxylate anions in the gas phase, J. Phys. Chem. A, 1999, 103, 35, 7008-7016, https://doi.org/10.1021/jp9908202 . [all data]


Notes

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