Trifluoromethyl peroxynitrate

• Formula: CF₃NO₄
• Molecular weight: 147.0102
• IUPAC Standard InChI: InChI=1S/CF3NO4/c2-1(3,4)8-9-5(6)7 Copy

  
• IUPAC Standard InChIKey: IRCOOTKZKSUTLW-UHFFFAOYSA-N Copy
• CAS Registry Number: 50311-48-3
• Chemical structure:
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• Information on this page:
  • Mass spectrum (electron ionization)
  • Vibrational and/or electronic energy levels
  • References
  • Notes
• Other data available:
  • Phase change data
• Data at other public NIST sites:
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Mass spectrum (electron ionization)

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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: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

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:   ?

State:   X

Additional references: Jacox, 1998, page 368; Jacox, 2003, page 395

Notes

References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Kopitzky, Willner, et al., 1998
Kopitzky, R.; Willner, H.; Mack, H.-G.; Pfeiffer, A.; Oberhammer, H., IR and UV Absorption Cross Sections, Vibrational Analysis, and the Molecular Structure of Trifluoromethyl Peroxynitrate, CF, Inorg. Chem., 1998, 37, 24, 6208, https://doi.org/10.1021/ic980776p . [all data]

Hohorst and DesMarteau, 1974
Hohorst, F.A.; DesMarteau, D.D., Reactions of trifluromethyl peroxy derivatives with inorganic nitrogen compounds. Synthesis and vibrational spectrum of trifluoromethyl peroxynitrate, Inorg. Chem., 1974, 13, 3, 715, https://doi.org/10.1021/ic50133a040 . [all data]

Chen, Young, et al., 1993
Chen, J.; Young, V.; Zhu, T.; Niki, H., Long-path Fourier-transform infrared spectroscopic study of the reactions of trifluoromethylperoxy and trifluoromethoxy radicals with nitrogen dioxide, J. Phys. Chem., 1993, 97, 45, 11696, https://doi.org/10.1021/j100147a024 . [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]

Notes

Go To: Top, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, References

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