Abstract
Quantum chemical studies of the reaction of selenium dichloride with divinyl sulfide have been carried out. The major reaction route (2,6-dichloro-1,4-thiaselenane → 5-chloro-2-chloromethyl-1,3-thiaselenolane → 2-chloromethyl-1,3-thiaselenole) and main trends of the reaction (a rearrangement of 2,6-dichloro-1,4-thiaselenane, facile selective dehydrochlorination of 5-chloro-2-chloromethyl-1,3-thiaselenolane), which have been determined by the quantum chemical studies, are in excellent agreement with experimental data.
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