Propane-1,1,1,3,3,3-d6

• Formula: C₃H₂D₆
• Molecular weight: 50.1326
• CAS Registry Number: 2875-96-9
• Information on this page:
  • Gas phase ion energetics data
  • Vibrational and/or electronic energy levels
  • References
  • Notes
• Data at other public NIST sites:
  • Gas Phase Kinetics Database
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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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

Appearance 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: Takehiko Shimanouchi

Symmetry:   C_2ν     Symmetry Number σ = 2

Source: Shimanouchi, 1972

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.

Stockbauer and Inghram, 1976
Stockbauer, R.; Inghram, M.G., The fragmentation of propane deuteropropane molecular ions, J. Chem. Phys., 1976, 65, 4081. [all data]

Lifshitz and Shapiro, 1967
Lifshitz, C.; Shapiro, M., Isotope effects on metastable transitions. II. CH₃CD₂CH₃, and CD₃CH₂CD₃, J. Chem. Phys., 1967, 46, 4912. [all data]

Shimanouchi, 1972
Shimanouchi, T., Tables of Molecular Vibrational Frequencies Consolidated Volume I, National Bureau of Standards, 1972, 1-160. [all data]

Notes

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• Symbols used in this document:
  

  AE	Appearance energy

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