pI-C6H4CH2 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

C7H6I- + Hydrogen cation = Benzene, 1-iodo-4-methyl-

By formula: C7H6I- + H+ = C7H7I

Quantity Value Units Method Reference Comment
Δr1558. ± 13.kJ/molG+TSWenthold, Wierschke, et al., 1994gas phase; Between MeCN and FCH2CH2OH
Quantity Value Units Method Reference Comment
Δr1527. ± 13.kJ/molIMRBWenthold, Wierschke, et al., 1994gas phase; Between MeCN and FCH2CH2OH

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

Electron affinity of neutral species

EAneutral (eV) Method Reference Comment
1.18 ± 0.16D-EAWenthold, Wierschke, et al., 1994Between MeCN and FCH2CH2OH

Protonation reactions

C7H6I- + Hydrogen cation = Benzene, 1-iodo-4-methyl-

By formula: C7H6I- + H+ = C7H7I

Quantity Value Units Method Reference Comment
Δr1558. ± 13.kJ/molG+TSWenthold, Wierschke, et al., 1994gas phase; Between MeCN and FCH2CH2OH
Quantity Value Units Method Reference Comment
Δr1527. ± 13.kJ/molIMRBWenthold, Wierschke, et al., 1994gas phase; Between MeCN and FCH2CH2OH

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.

Wenthold, Wierschke, et al., 1994
Wenthold, P.G.; Wierschke, S.G.; Nash, J.J.; Squires, R.R., Biradical thermochemistry from collision-induced dissociation threshold energy measurements .2. Experimental and theoretical studies of the Mechanism and Thermochemistry of Formation of alph, J. Am. Chem. Soc., 1994, 116, 16, 7378, https://doi.org/10.1021/ja00095a048 . [all data]


Notes

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