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Calculation of infrared raman scattering parameters for vibrational and rotational levels of molecules

✍ Scribed by V. L. Derbov; M. A. Kovner; S. K. Potapov

Publisher
Springer US
Year
1974
Tongue
English
Weight
344 KB
Volume
21
Category
Article
ISSN
0021-9037

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The structural parameters and conformational stabilities of the trans (the CÈCl bond is trans to the phosphorus lone pair) and gauche rotamers of chloromethyldichlorophosphine, were obtained from ab initio cal-ClCH 2 PCl 2 , culations up to the MP2/6-311 + G\*\* level. In each case the gauche form w