AB inttio study of the rotational isomlrism, vibrational force field and frequencies of vinyl mercaptan
- 31 December 1978
- journal article
- Published by Elsevier in Journal of Molecular Structure
- Vol. 48 (1) , 133-138
- https://doi.org/10.1016/0022-2860(78)87232-9
Abstract
No abstract availableThis publication has 12 references indexed in Scilit:
- Ethenethiol: an infared and microwave spectroscopic studyJournal of the Chemical Society, Chemical Communications, 1977
- Potential for rotation about C(sp2)-O and C(sp2)-S bonds: electron diffraction results for CH2CH-OCH3 and CH2Journal of Molecular Structure, 1975
- Ab initio calculation of the force field of ethyleneJournal of Molecular Spectroscopy, 1971
- On isotopic substitution and the choice between alternative sets of force constants; with special reference to the cases of ethylene, ketene, diazomethane and formaldehydeSpectrochimica Acta Part A: Molecular Spectroscopy, 1971
- Normal Coordinates: General Theory, Redundant Coordinates, and General Analysis Using Electronic ComputersThe Journal of Chemical Physics, 1971
- Einige frequenzverschiebungen durch 13C-substitution in den IR-spektren von C2H4, C2D4 und C2H6; ihre verwen-dung zur kraftJournal of Molecular Structure, 1970
- Ab initiocalculation of force constants and equilibrium geometries in polyatomic moleculesMolecular Physics, 1969
- Internal rotation in propargyl alcohol from microwave spectrumJournal of Molecular Spectroscopy, 1968
- Application of the hybrid orbital force field to a seriesof CH2X moleculesJournal of Molecular Spectroscopy, 1968
- Torsional Coordinates in Vibrational Anharmonicity; Application to EthyleneThe Journal of Chemical Physics, 1966