Generation of the atrane cations by nuclear-chemical method: Quantum-chemical study
- Авторы: Ignat’ev I.1, Kochina T.2, Avrorin V.1, Ermolenko Y.1
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Учреждения:
- St. Petersburg State University
- Grebenshchikov Institute of Silicate Chemistry
- Выпуск: Том 87, № 6 (2017)
- Страницы: 1119-1124
- Раздел: Article
- URL: https://journals.rcsi.science/1070-3632/article/view/220121
- DOI: https://doi.org/10.1134/S1070363217060032
- ID: 220121
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Аннотация
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.
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Об авторах
I. Ignat’ev
St. Petersburg State University
Email: t-kochina@mail.ru
Россия, St. Petersburg
T. Kochina
Grebenshchikov Institute of Silicate Chemistry
Автор, ответственный за переписку.
Email: t-kochina@mail.ru
Россия, nab. Makarova 2, St. Petersburg, 199034
V. Avrorin
St. Petersburg State University
Email: t-kochina@mail.ru
Россия, St. Petersburg
Yu. Ermolenko
St. Petersburg State University
Email: t-kochina@mail.ru
Россия, St. Petersburg