Crystal structure of 1-{2-[(2-methoxyphenyl)selanyl]phenyl}-4-phenyl-1H-1,2,3-triazole

Crystal structure of 1-{2-[(2-methoxyphenyl)selanyl]phenyl}-4-phenyl-1H-1,2,3-triazole

In the title compound, C21H17N3OSe, the dihedral angles between the central five-membered ring and the C- and N-bound rings are 17.89 (10) and 42.35 (10)°, respectively, indicating the molecule is twisted. The dihedral angle between the Se-bound rings is 85.36 (10)°. A close intramolecular Se...O co...

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Bibliographic Details
Main Authors: Leandro R. S. Camargo, Julio Zukerman-Schpector, Anna M. Deobald, Antonio L. Braga, Edward R. T. Tiekink
Format: Article
Language:English
Published: International Union of Crystallography 2015-03-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
organoselenium
Se...O halogen bonding
hydrogen bonding
C—H...π interactions
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989015003230
Description
Summary:In the title compound, C21H17N3OSe, the dihedral angles between the central five-membered ring and the C- and N-bound rings are 17.89 (10) and 42.35 (10)°, respectively, indicating the molecule is twisted. The dihedral angle between the Se-bound rings is 85.36 (10)°. A close intramolecular Se...O contact of 2.8507 (13) Å is noted. In the crystal, C—H...O, C—H...N and C—H...π interactions lead to the formation of supramolecular layers parallel to (011); these stack with no specific intermolecular interactions between them.
ISSN:2056-9890

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