Anion···π-system interactions in crystals of 4-amino-1-(β-phenylethyl)-1,2,4-triazolium bromide.

Autor:	Shishkina, S., Zubatyuk, R., Kucherenko, L., Parnyuk, N., Mazur, I., Georgievskii, G., Shishkin, O.
Předmět:	ANIONS CRYSTAL structure STYRENE INTERMOLECULAR interactions BROMIDES X-ray diffraction QUANTUM chemistry
Zdroj:	Russian Chemical Bulletin; Aug2013, Vol. 62 Issue 8, p1900-1906, 7p
Abstrakt:	The character of intermolecular interactions of the bromide anion and organic cation in crystal of 4-amino-1-(β-phenylethyl)-1,2,4-triazolium bromide was studied by a combination of X-ray diffraction data and M06-2X/cc-pvtz quantum chemical calculations. The existence of binding anion...π-system interactions was shown, and their characteristics were studied. [ABSTRACT FROM AUTHOR]
Databáze:	Complementary Index
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