Infrared absorption intensities of methylene fluoride
- 31 December 1976
- journal article
- Published by Elsevier BV in Spectrochimica Acta Part A: Molecular Spectroscopy
- Vol. 32 (5), 1077-1082
- https://doi.org/10.1016/0584-8539(76)80292-9
Abstract
Absolute i.r. band intensifies of gaseous CH2F2, and CD2F2, have been measured with the aid of the pressure broadening technique to determine the dipole moment derivatives with respect to a bond length or a valence angle. Among several sets of converged values of parameter in the least squares calculation, the most reliable one has been chosen by comparing with the calculated results through the CNDO/2 and INDO methods. The determined values of aCH and aCF are −0.73 ± 0.14 and −4.23 ± 0.84 D/Å, respectively. The angles between those parameters and the symmetry axis of the molecule are 67.5 ± 11.O° for aCH and 73.9 ±11.1° for aCF. When compared with the parameter values of other fluorinated methanes reported in our previous paper, these results can be considered quite reasonable.Keywords
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