- Formula: C12H12
- Molecular weight: 156.2237
- IUPAC Standard InChI:
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- IUPAC Standard InChIKey: RJTJVVYSTUQWNI-UHFFFAOYSA-N
- CAS Registry Number: 939-27-5
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
- Other names: «beta»-Ethylnaphthalene; 2-Ethylnaphthalene
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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
B - John E. Bartmess
Electron affinity determinations
|<0.195 ± 0.061||ECD||Wojnarovits and Foldiak, 1981||EA is an upper limit: Chen and Wentworth, 1989. G3MP2B3 calculations indicate an EA of ca. -0.1 eV, anion unbound.; B|
Ionization energy determinations
|7.95||PE||Klasinc, Kovac, et al., 1983||LBLHLM|
|7.95||PE||Klasinc, Kovac, et al., 1983||Vertical value; LBLHLM|
Go To: Top, Gas phase ion energetics data, Notes
Wojnarovits and Foldiak, 1981
Wojnarovits, L.; Foldiak, G., Electron capture detection of aromatic hydrocarbons, J. Chromatogr. Sci., 1981, 206, 511. [all data]
Chen and Wentworth, 1989
Chen, E.C.M.; Wentworth, W.E., Experimental Determination of Electron Affinities of Organic Molecules, Mol. Cryst. Liq. Cryst., 1989, 171, 271. [all data]
Klasinc, Kovac, et al., 1983
Klasinc, L.; Kovac, B.; Gusten, H., Photoelectron spectra of acenes. Electronic structure and substituent effects, Pure Appl. Chem., 1983, 55, 289. [all data]
Go To: Top, Gas phase ion energetics data, References
- Symbols used in this document:
EA Electron affinity
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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