2,3-Dioxabicyclo[2.2.1]heptane
- Formula: C5H8O2
- Molecular weight: 100.1158
- IUPAC Standard InChI: InChI=1S/C5H8O2/c1-2-5-3-4(1)6-7-5/h4-5H,1-3H2
- IUPAC Standard InChIKey: RNFXAEBUWFIOQW-UHFFFAOYSA-N
- CAS Registry Number: 279-35-6
- Chemical structure:
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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 as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Ionization energy determinations
| IE (eV) | Method | Reference | Comment |
|---|---|---|---|
| 8.96 | PE | Gleiter, Dobler, et al., 1984 | Vertical value; LBLHLM |
| 8.96 | PE | Gleiter, Schang, et al., 1980 | Vertical value; LLK |
| 8.99 | PE | Coughlin, Brown, et al., 1979 | Vertical value; LLK |
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.
Gleiter, Dobler, et al., 1984
Gleiter, R.; Dobler, W.; Eckert-Maksic, M.; Bloodworth, A.J.; Eggelte, H.J.; Cremer, D.,
Photoelectron spectra of dioxabicyclo[n.2.1]alkanes,
J. Org. Chem., 1984, 49, 3716. [all data]
Gleiter, Schang, et al., 1980
Gleiter, R.; Schang, P.; Adam, W.; Eggelte, H.J.; Erden, I.; Bloodworth, A.J.,
Photoelectron spectra of bicyclic peroxides,
J. Electron Spectrosc. Relat. Phenom., 1980, 19, 223. [all data]
Coughlin, Brown, et al., 1979
Coughlin, D.J.; Brown, R.S.; Salomon, R.G.,
The prostaglandin endoperoxide nucleus and related bicyclic peroxides. Synthetic and spectroscopic studies,
J. Am. Chem. Soc., 1979, 101, 1533. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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