Quantum and chemical research of the mechanism of protoning 2-metilgeksena-1 MNDO method
Автор: Babkin Vladimir Alexandrovich, Andreev Dmitry Sergeevich, Fomichev Valery Tarasovich
Журнал: НБИ технологии @nbi-technologies
Рубрика: Технико-технологические инновации
Статья в выпуске: 7, 2012 года.
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For the first time it is researched of classical quantum chemical method MNDO of modeling mechanism protonizataion of 2-methylhexene-1 - monomer of cationic polymerization. Reaction exothermic and carry without a barrier character. The values of the energy gain in result of reaction and of affinity proton to 2-methylhexene-1 was theoretical estimation.
Gas phase, метод mndo, method mndo, mechanism of protonizataion, quantum chemical, 2-methylhexene-1
Короткий адрес: https://sciup.org/14968245
IDR: 14968245
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