Bulletin of the Korean Chemical Society

Korean Chemical Society (대한화학회)
권호 표지
DOI QR코드

DOI QR Code

The Dipole Moment Derivatives of Methane

  • Kim, Kwan (Department of Chemistry, College of Natural Sciences, Seoul National University) ;
  • Park, Cheol-Woo (Department of Chemistry, College of Natural Sciences, Seoul National University)
  • Published : 1986.10.20
Download PDF
⟨ Previous Next ⟩

Abstract

The infrared intensities of $CH_{4}$ and $CD_{4}$ are analyzed. The experimental dipole moment derivatives thus obtained are compared with corresponding values from the molecular orbital calculations. The theoretical results are analyzed for the charge-charge flux-overlap(CCFO) electronic contributions to the dipole derivatives.

Keywords

References

  1. Vibrational Intensities in Infrared and Raman Spectroscopy W.B. Person;G. Zerbi(eds.)
  2. J. Chem. Phys. v.61 W.B. Person;J.H. Newton
  3. Bull. Kor. Chem. Soc. v.6 K. Kim;H.G. Lee
  4. J. Quant. Spectrosc. Radia. Transfer K. Kim
  5. J. Phys. Chem. v.80 W.T. King;G.B. Mast
  6. Bull. Kor. Chem. Soc. v.6 K. Kim
  7. Molecular Vibrations E.B. Wilson, Jr.;J.C. Decius;P.C. Cross
  8. Mol. Spectrosc. v.2 W.B. Person;D. Steele
  9. Spectrochim. Acta v.20 J.L. Duncan;I.M. Mills
  10. Nucl. Data Tables v.A9 A.H. Wapstra;N.B. Gove
  11. Interatomic Distances L.E. Sutton
  12. J. Phys. Chem. v.84 J.H.F. Bode;W.M.A. Smit
  13. Quantum Chem. Program Exchange, QCPE v.10 W.J. Hehre;W.A. Latham;R. Ditchfield;M.D. Newton;J.A. Pople
  14. J. Chem. Phys. v.56 W. Meyer;P. Pulay
  15. Spectrochim. Acta S. Saeki;M. Mizuno;S. Kondo
  16. J. Mol. Spectrosc. v.5 R.E. Hiller, Jr.;J.W. Straley
  17. Mol. Phys. v.37 D.L. Gray;A.G. Robiette
  18. J. Mol. Struct. v.140 M.N. Ramos;B.B. Neto
  19. J. Mol. Spectrosc. v.57 J.C. Decius

Cited by

  1. Dipole moment derivatives and infrared intensities in fluoromethanes vol.161, pp.None, 1986, https://doi.org/10.1016/0022-2860(87)85082-2