|
Эта публикация цитируется в 13 научных статьях (всего в 13 статьях)
The role of H-bonds in charge transfer in the crystal of 1,5-naphthalenedisulfonic acid tetrahydrate
K. A. Lyssenkoa, P. Yu. Barzilovichb, S. M. Aldoshinb, M. Yu. Antipina, Yu. A. Dobrovolskyb
a A.N. Nesmeyanov Institute of Organoelement Compounds of Russian Academy of Sciences, Moscow, Russian Federation
b Institute of Problems of Chemical Physics, Russian Academy of Sciences, Chernogolovka, Moscow Region, Russian Federation
Аннотация:
Electron density analysis in the title compound has revealed that, due to H-bond formation, the total charges of the dianion and H5O2+ cation are substantially decreased and bond length distribution in the SO3 moiety can be directly related to the total energy of the cation–anion interactions and partial charges.
Ключевые слова:
Zundel ion, H-bond, charge density, topological analysis, charge transfer.
Образцы ссылок на эту страницу:
https://www.mathnet.ru/rus/mendc3339
|
|
Обратная связь: