Angular dependence of the β-proton hyper
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Maurizio Guerra
📂
Article
📅
1987
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Elsevier Science
🌐
English
⚖ 584 KB
The p-proton hypertine coupling constants in S-substituted ethyl radicals CH2-CH2-X (X=CHJ, NH2, OH, F, SiH9, PH2, SH, Cl) were computed as a function of the rotational angle (Y about the C.C, bond by ab initio calculations at the UHF/DZ+d level. They follow the relation aHg (0,a) =A+ B cos\*O + Cco