Potential function of internal rotation of (CH3)2CClNO, CH3CCl2NO, and their deuterium analogs
β Scribed by S. V. Trepalin; A. V. Yarkov; V. B. Sokolov; A. N. Ivanov
- Book ID
- 112448114
- Publisher
- Springer
- Year
- 1990
- Tongue
- English
- Weight
- 437 KB
- Volume
- 39
- Category
- Article
- ISSN
- 1573-9171
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The energy decomposition analysis of Morokuma and Kitaura-Morokuma is used to clucidatc the origin of the rotational barrier. The barrier of ethane, defined as the difference between the methyl radical-methyl radical interaction energy in a staggered and an eclipsed conformation, is found to be domi
The ultravlolct absorption spectra of H02NOz. CCl3O2NO2, CCl2r02N02, and CHJO~NO~ were measured from 210 10 280 nm The spectra arc snn~lar. and the absorption mtcnslty mcrcxcs as the w.wclcngth decreases wth a shoulder at =255 nm Axsummg that cvcry absorption lcnds to photodlssoclatlon. the photodwo