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1,4-Butanedithiol

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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

De-protonation reactions

C4H9S2- + Hydrogen cation = 1,4-Butanedithiol

By formula: C4H9S2- + H+ = C4H10S2

Quantity Value Units Method Reference Comment
Deltar344.0 ± 2.6kcal/molG+TSKarty, Wu, et al., 2001gas phase
Quantity Value Units Method Reference Comment
Deltar341.6 ± 2.1kcal/molIMREKarty, Wu, et al., 2001gas phase

References

Go To: Top, 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.

Karty, Wu, et al., 2001
Karty, J.M.; Wu, Y.S.; Brauman, J.I., The RS-center dot HSR hydrogen bond: Acidities of alpha,omega- dithiols and electron affinities of their monoradicals, J. Am. Chem. Soc., 2001, 123, 40, 9800-9805, https://doi.org/10.1021/ja0039684 . [all data]


Notes

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