3-CO2Me-bicyclo[1.1.1]pentane-1-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

C8H9O4- + Hydrogen cation = C8H10O4

By formula: C8H9O4- + H+ = C8H10O4

Quantity Value Units Method Reference Comment
Δr1421. ± 8.8kJ/molG+TSAdcock, Baran, et al., 2005gas phase; Entropy of acidity reassigned at 24 eu; authors did not take symmetry changes into account
Quantity Value Units Method Reference Comment
Δr1391. ± 8.4kJ/molCIDCAdcock, Baran, et al., 2005gas phase; Entropy of acidity reassigned at 24 eu; authors did not take symmetry changes into account

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.

Adcock, Baran, et al., 2005
Adcock, W.; Baran, Y.; Filippi, A.; Speranza, M.; Trout, N.A., Polar substituent effects in the bicyclo[1.1.1]pentane ring system: Acidities of 3-substituted bicyclo[1.1.1]pentane-1-carboxylic acids, J. Org. Chem., 2005, 70, 3, 1029-1034, https://doi.org/10.1021/jo040236b . [all data]


Notes

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