N. P. Gritsan, E. A. Pritchina, “Are aroylnitrenes species with a singlet ground state?”, Mendeleev Commun., 11:3 (2001), 94

Эта публикация цитируется в 42 статьях

Are aroylnitrenes species with a singlet ground state?

N. P. Gritsan^a, E. A. Pritchina^b

^a V.V. Voevodsky Institute of Chemical Kinetics and Combustion, Siberian Branch of the Russian Academy of Sciences, Novosibirsk, Russian Federation
^b Department of Natural Sciences, Novosibirsk State University, Novosibirsk, Russian Federation

Аннотация: The B3LYP calculations of the properties of singlet and triplet benzoylnitrenes and naphthoylnitrenes testify to the stabilization of the 1A’ state relative to the 3A” state due to the intermediacy of an NCO structure between nitrene and oxazirene in the 1A’ state.

Язык публикации: английский

DOI: 10.1070/MC2001v011n03ABEH001376