4-Fluorobenzyl radical

• Formula: C₇H₆F
• Molecular weight: 109.1209
• IUPAC Standard InChI: InChI=1S/C7H6F/c1-6-2-4-7(8)5-3-6/h2-5H,1H2 Copy

  
• IUPAC Standard InChIKey: GVVVXNGTIKFYKV-UHFFFAOYSA-N Copy
• CAS Registry Number: 2194-09-4
• Chemical structure:
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• Information on this page:
  • Gas phase ion energetics data
  • Vibrational and/or electronic energy levels
  • References
  • Notes
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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:
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
B - John E. Bartmess

View reactions leading to C₇H₆F⁺ (ion structure unspecified)

Electron affinity determinations

Ionization energy determinations

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:   A

State:   X

Additional references: Jacox, 1998, page 370; Jacox, 2003, page 402; Baek and Lee, 1998

Notes

References

Go To: Top, Gas phase ion energetics data, 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.

Kim, Wenthold, et al., 1999
Kim, J.B.; Wenthold, P.G.; Lineberger, W.C., Ultraviolet photoelectron spectroscopy of o-, m-, and p-halobenzyl anions, J. Phys. Chem. A, 1999, 103, 50, 10833-10841, https://doi.org/10.1021/jp992817o . [all data]

Harrison, Kebarle, et al., 1961
Harrison, A.G.; Kebarle, P.; Lossing, F.P., Free radicals by mass spectrometry. XXI. The ionization potentials of some meta and para substituted benzyl radicals, J. Am. Chem. Soc., 1961, 83, 777. [all data]

Bindley, Watts, et al., 1964
Bindley, T.F.; Watts, A.T.; Walker, S., Electronic emission spectra of radicals from fluorotoluenes, Trans. Faraday Soc., 1964, 60, 1, https://doi.org/10.1039/tf9646000001 . [all data]

Charlton and Thrush, 1986
Charlton, T.R.; Thrush, B.A., The study of substituted benzyl radicals by laser-induced fluorescence, Chem. Phys. Lett., 1986, 125, 5-6, 547, https://doi.org/10.1016/0009-2614(86)87096-8 . [all data]

Cossart-Magos and Cossart, 1988
Cossart-Magos, C.; Cossart, D., Rotational band contours of the first electronic transition origin bands of p-xylyl and p-fluorobenzyl, Mol. Phys., 1988, 65, 3, 627, https://doi.org/10.1080/00268978800101291 . [all data]

Fukushima and Obi, 1990
Fukushima, M.; Obi, K., Jet spectroscopy and excited state dynamics of benzyl and substituted benzyl radicals, J. Chem. Phys., 1990, 93, 12, 8488, https://doi.org/10.1063/1.459710 . [all data]

Lee and Baek, 1999
Lee, S.K.; Baek, D.Y., Vibronic analysis of the jet-cooled emission spectrum of p-fluorobenzyl radical in the D1→D0 transition, Chem. Phys. Lett., 1999, 301, 3-4, 407, https://doi.org/10.1016/S0009-2614(98)01436-5 . [all data]

Kim, Wenthold, et al., 1999, 2
Kim, J.B.; Wenthold, P.G.; Lineberger, W.C., Ultraviolet Photoelectron Spectroscopy of, J. Phys. Chem. A, 1999, 103, 50, 10833, https://doi.org/10.1021/jp992817o . [all data]

Jacox, 1998
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules: supplement A, J. Phys. Chem. Ref. Data, 1998, 27, 2, 115-393, https://doi.org/10.1063/1.556017 . [all data]

Jacox, 2003
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules: supplement B, J. Phys. Chem. Ref. Data, 2003, 32, 1, 1-441, https://doi.org/10.1063/1.1497629 . [all data]

Baek and Lee, 1998
Baek, D.Y.; Lee, S.K., Bull. Korean Chem. Soc., 1998, 19, 1359. [all data]

Notes

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• Symbols used in this document:
  

  EA	Electron affinity

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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