7-Oxabicyclo[2.2.1]heptane


Condensed phase 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfliquid-53.51 ± 0.48kcal/molCcbBedford, Beezer, et al., 1963 
Quantity Value Units Method Reference Comment
Δcliquid-852.37 ± 0.36kcal/molCcrAndruzzi, Pilcher, et al., 1977Corresponding Δfliquid = -53.51 kcal/mol (simple calculation by NIST; no Washburn corrections)
Δcliquid-852.37 ± 0.37kcal/molCcbBedford, Beezer, et al., 1963Corresponding Δfliquid = -53.51 kcal/mol (simple calculation by NIST; no Washburn corrections)

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 evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias

Data compiled as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

View reactions leading to C6H10O+ (ion structure unspecified)

Quantity Value Units Method Reference Comment
Proton affinity (review)201.8kcal/molN/AHunter and Lias, 1998HL
Quantity Value Units Method Reference Comment
Gas basicity195.2kcal/molN/AHunter and Lias, 1998HL

Ionization energy determinations

IE (eV) Method Reference Comment
9.57 ± 0.02PEBain, Bunzli, et al., 1973Vertical value; LLK

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.

Bedford, Beezer, et al., 1963
Bedford, A.F.; Beezer, A.E.; Mortimer, C.T.; Springall, H.D., Heats of combustion and molecular structure. Part IX. Bicylo[2,2,1]heptane, 7-oxabicyclo[2,2,1]heptane, and exo- and endo-2-methyl-7-oxabicyclo[2,2,1]heptane, J. Chem. Soc., 1963, 3823-3828. [all data]

Andruzzi, Pilcher, et al., 1977
Andruzzi, F.; Pilcher, G.; Virmani, Y.; Plesch, P.H., Enthalpy of polymerization of 7-oxabicyclo[2.2.1]heptane, and exo- and endo-2-methyl-7-oxabicyclo[2.2.1]heptane, Makromol. Chem., 1977, 178, 2367-2373. [all data]

Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G., Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update, J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018 . [all data]

Bain, Bunzli, et al., 1973
Bain, A.D.; Bunzli, J.C.; Frost, D.C.; Weiler, L., Photoelectron spectra of cyclic ethers, J. Am. Chem. Soc., 1973, 95, 291. [all data]


Notes

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