Neopentyl radical

• Formula: C₅H₁₁
• Molecular weight: 71.1408
• IUPAC Standard InChI: InChI=1S/C5H11/c1-5(2,3)4/h1H2,2-4H3 Copy

  
• IUPAC Standard InChIKey: GJWHXWMUGWZNTO-UHFFFAOYSA-N Copy
• CAS Registry Number: 3744-21-6
• 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:
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
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
B - John E. Bartmess

View reactions leading to C₅H₁₁⁺ (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:   X

Additional references: Jacox, 1994, page 386

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.

DePuy, Gronert, et al., 1989
DePuy, C.H.; Gronert, S.; Barlow, S.E.; Bierbaum, V.M.; Damrauer, R., The Gas Phase Acidities of the Alkanes, J. Am. Chem. Soc., 1989, 111, 6, 1968, https://doi.org/10.1021/ja00188a003 . [all data]

Schultz, Houle, et al., 1984
Schultz, J.C.; Houle, F.A.; Beauchamp, J.L., Photoelectron spectroscopy of 1-propyl, 1-butyl, isobutyl, neopentyl and 2-butyl radicals: Free radical precursors to high energy carbonium ion isomers, J. Am. Chem. Soc., 1984, 106, 3917. [all data]

Lossing and Maccoll, 1976
Lossing, F.P.; Maccoll, A., Free radicals by mass spectrometry, XLVII. Ionization potentials ionic and heats of formation of C₅-C₇ alkyl radicals, Can. J. Chem., 1976, 54, 990. [all data]

Taubert and Lossing, 1962
Taubert, R.; Lossing, F.P., Free radicals by mass spectrometry. XXVII. Ionization potentials of four pentyl radicals, J. Am. Chem. Soc., 1962, 84, 1523. [all data]

Pacansky, Brown, et al., 1981
Pacansky, J.; Brown, D.W.; Chang, J.S., Infrared spectra of the isobutyl and neopentyl radicals. Characteristic spectra of primary, secondary, and tertiary alkyl radicals, J. Phys. Chem., 1981, 85, 17, 2562, https://doi.org/10.1021/j150617a029 . [all data]

Jacox, 1994
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules, American Chemical Society, Washington, DC, 1994, 464. [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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