C6H5CD2+
- Formula: C7H5D2+
- Molecular weight: 93.1423
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Vibrational and/or electronic energy levels
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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: Marilyn E. Jacox
State: X
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
a1 | 13 | Ring deform. | 500 | T | gas | PE TPE | Houle and Beauchamp, 1978 Eiden, Weinhold, et al., 1991 Eiden, Lu, et al., 1996 |
a2 | 17 | 278 | H | gas | TPE | Eiden, Lu, et al., 1996 | |
b1 | 23 | 349 | T | gas | TPE | Eiden, Lu, et al., 1996 | |
24 | 145 | T | gas | TPE | Eiden, Lu, et al., 1996 | ||
b2 | 32 | 880 | T | gas | TPE | Eiden, Lu, et al., 1996 | |
33 | 862 | T | gas | TPE | Eiden, Lu, et al., 1996 | ||
34 | 779 | T | gas | TPE | Eiden, Lu, et al., 1996 | ||
35 | Ring deform. | 575 ± 2 | gas | TPE | Eiden, Weinhold, et al., 1991 Eiden, Lu, et al., 1996 | ||
36 | 302 ± 2 | gas | TPE | Eiden, Lu, et al., 1996 | |||
Notes
H | (1/2)(2ν) |
T | Tentative assignment or approximate value |
References
Go To: Top, Vibrational and/or electronic energy levels, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Houle and Beauchamp, 1978
Houle, F.A.; Beauchamp, J.L.,
Detection and investigation of allyl and benzyl radicals by photoelectron spectroscopy,
J. Am. Chem. Soc., 1978, 100, 3290. [all data]
Eiden, Weinhold, et al., 1991
Eiden, G.C.; Weinhold, F.; Weisshar, J.C.,
Photoelectron spectroscopy of free radicals with cm-1 resolution: The benzyl cation,
J. Chem. Phys., 1991, 95, 8665. [all data]
Eiden, Lu, et al., 1996
Eiden, G.C.; Lu, K.-T.; Badenhoop, J.; Weinhold, F.; Weisshaar, J.C.,
Threshold photoionization spectra of benzyl radical: Cation vibrational states and ab initio calculations,
J. Chem. Phys., 1996, 104, 22, 8886, https://doi.org/10.1063/1.471624
. [all data]
Notes
Go To: Top, Vibrational and/or electronic energy levels, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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