Bicyclo[2.2.0]hexa-2,5-diene
- Formula: C6H6
- Molecular weight: 78.1118
- IUPAC Standard InChI: InChI=1S/C6H6/c1-2-6-4-3-5(1)6/h1-6H
- IUPAC Standard InChIKey: CTLSARLLLBZBRV-UHFFFAOYSA-N
- CAS Registry Number: 5649-95-6
- 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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
View reactions leading to C6H6+ (ion structure unspecified)
Ionization energy determinations
| IE (eV) | Method | Reference | Comment |
|---|---|---|---|
| 9.0 ± 0.1 | PE | Bieri, Burger, et al., 1977 | LLK |
| 9.4 ± 0.1 | PE | Bieri, Burger, et al., 1977 | Vertical value; LLK |
| 9.40 | PE | Bieri, Heilbronner, et al., 1976 | Vertical value; LLK |
| 9.4 | PE | Bieri, Heibronner, et al., 1975 | Vertical value; LLK |
References
Go To: Top, Gas phase ion energetics data, NIST Free Links, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Bieri, Burger, et al., 1977
Bieri, G.; Burger, F.; Heilbronner, E.; Maier, J.P.,
Valence ionization enrgies of hydrocarbons,
Helv. Chim. Acta, 1977, 60, 2213. [all data]
Bieri, Heilbronner, et al., 1976
Bieri, G.; Heilbronner, E.; Kobayashi, T.; Schmelzer, A.; Goldstein, M.J.; Leight, R.S.; Lipton, M.S.,
286. Dewar benzene some of its derivatives. A photoelectron spectroscopic analysis,
Helv. Chim. Acta, 1976, 59, 2657. [all data]
Bieri, Heibronner, et al., 1975
Bieri, G.; Heibronner, E.; Goldstein, M.J.; Leight, R.S.; Lipton, M.S.,
The photoelectron spectrum of dewar benzene,
Tetrahedron Lett., 1975, 8, 581. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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