Analysis of torsional spectra of molecules with two internal C3v rotors. II. Far infrared and low frequency Raman spectra of dimethylether isotopes
- 1 March 1977
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 66 (5) , 1856-1874
- https://doi.org/10.1063/1.434184
Abstract
The torsional far infrared and Raman spectra of gaseous CH3OCH3, CD3OCH3, and CD3OCD3 are presented. They are analyzed using a computer program which is based on the results of an extensive investigation of the isometric groups and of the symmetry groups of the rotation–internal rotation Hamiltonians of a series of semirigid two-top models. Four or more Fourier coefficients of the potential functions in two variables could be determined for each isotope. Strong evidence was found for Fermi-resonance-type interactions with the COC bending mode.Keywords
This publication has 25 references indexed in Scilit:
- Analysis of torsional splittings in the microwave spectra of dimethylether, CH3OCH3 and its isotopes, CD3OCH3 and CD3OCD3Journal of Molecular Spectroscopy, 1976
- ErratumMolecular Physics, 1976
- The isometric group of non-rigid moleculesMolecular Physics, 1974
- Molecular orbital theory of the electronic structure of organic compounds. XXI. Rotational potentials for germinal methyl groupsJournal of the American Chemical Society, 1974
- Low Frequency Vibrations in Molecular Solids. XII. Low Frequency Modes and Barriers to Internal Rotation of Some Dimethyl Compounds of Elements in Group VIThe Journal of Chemical Physics, 1971
- Internal Rotation in (CH3)2X Molecules of C2υ Symmetry–Barrier to Internal Rotation in Dimethyl EtherThe Journal of Chemical Physics, 1971
- Infrared spectra and internal rotation in propane, isobutane and neopentaneSpectrochimica Acta Part A: Molecular Spectroscopy, 1969
- Calcul du champ de force de valence et des coordonnées normales de l'ether diméthylique à partir des frequeneces de vibration des molécules (CH3)2O, (CD3)2O et CH3OCD3Spectrochimica Acta Part A: Molecular Spectroscopy, 1968
- Internal Rotation in Propane: Reanalysis of the Microwave Spectrum and Quantum-Mechanical CalculationsThe Journal of Chemical Physics, 1968
- Torsional frequencies in the far infrared—II: Molecules with two or three methyl rotorsSpectrochimica Acta, 1962