Generation of the atrane cations by nuclear-chemical method: Quantum-chemical study
- Autores: Ignat’ev I.1, Kochina T.2, Avrorin V.1, Ermolenko Y.1
-
Afiliações:
- St. Petersburg State University
- Grebenshchikov Institute of Silicate Chemistry
- Edição: Volume 87, Nº 6 (2017)
- Páginas: 1119-1124
- Seção: Article
- URL: https://journals.rcsi.science/1070-3632/article/view/220121
- DOI: https://doi.org/10.1134/S1070363217060032
- ID: 220121
Citar
Resumo
Comparative analysis of equilibrium structures of cations [RM(OCH2CH2)2NCH3]+ (M = Si, Ge; R = F, Me, Ph) and the corresponding neutral compounds HRM(OCH2CH2)2NCH3 was performed based on quantum-chemical calculations. The possibility was analyzed for expanding nuclear-chemical method to generation of cations having the atrane structure. Quantum-chemical method was applied to estimate the heights of barriers to hydrolysis by the М–О bond in ocanes acting as the sources of the corresponding cations with the atrane structure.
Palavras-chave
Sobre autores
I. Ignat’ev
St. Petersburg State University
Email: t-kochina@mail.ru
Rússia, St. Petersburg
T. Kochina
Grebenshchikov Institute of Silicate Chemistry
Autor responsável pela correspondência
Email: t-kochina@mail.ru
Rússia, nab. Makarova 2, St. Petersburg, 199034
V. Avrorin
St. Petersburg State University
Email: t-kochina@mail.ru
Rússia, St. Petersburg
Yu. Ermolenko
St. Petersburg State University
Email: t-kochina@mail.ru
Rússia, St. Petersburg