1-[2-(2,5-Dichlorobenzyloxy)-2-phenylethyl]-1H-benzotriazole
1-[2-(2,5-Dichlorobenzyloxy)-2-phenylethyl]-1H-benzotriazole
In the title molecule, C21H17Cl2N3O, the benzotriazole ring is oriented at dihedral angles of 48.72 (6) and 62.94 (5)degrees, respectively, to the phenyl and benzene rings and the dihedral angle between the phenyl and benzene rings is 88.95 (6)degrees. In the crystal, weak C-H center dot center dot center dot N hydrogen bonds link the molecules into chains. pi-pi contacts between the triazole and benzene rings [centroid-centroid distance = 3.678 (1) angstrom] and a weak C-H center dot center dot center dot pi interaction are also observed.
o3177-o3178
Özel Güven, Özden
e8235f83-d94f-4974-8f83-c1e05b98727c
Bayraktar, Meral
f48b287f-5cf0-4b2b-9ad8-c38b6b513f79
Coles, Simon J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Hökelek, Tuncer
280189f8-322d-4081-9109-e49fd65d9acf
December 2011
Özel Güven, Özden
e8235f83-d94f-4974-8f83-c1e05b98727c
Bayraktar, Meral
f48b287f-5cf0-4b2b-9ad8-c38b6b513f79
Coles, Simon J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Hökelek, Tuncer
280189f8-322d-4081-9109-e49fd65d9acf
Özel Güven, Özden, Bayraktar, Meral, Coles, Simon J. and Hökelek, Tuncer
(2011)
1-[2-(2,5-Dichlorobenzyloxy)-2-phenylethyl]-1H-benzotriazole.
Acta Crystallographica Section E: Structure Reports Online, 67 (12), .
(doi:10.1107/s1600536811044783).
Abstract
In the title molecule, C21H17Cl2N3O, the benzotriazole ring is oriented at dihedral angles of 48.72 (6) and 62.94 (5)degrees, respectively, to the phenyl and benzene rings and the dihedral angle between the phenyl and benzene rings is 88.95 (6)degrees. In the crystal, weak C-H center dot center dot center dot N hydrogen bonds link the molecules into chains. pi-pi contacts between the triazole and benzene rings [centroid-centroid distance = 3.678 (1) angstrom] and a weak C-H center dot center dot center dot pi interaction are also observed.
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Published date: December 2011
Organisations:
Organic Chemistry: Synthesis, Catalysis and Flow
Identifiers
Local EPrints ID: 346096
URI: http://eprints.soton.ac.uk/id/eprint/346096
PURE UUID: 199916c3-60f4-4edf-afcb-4dd69d61d363
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Date deposited: 12 Dec 2012 16:56
Last modified: 15 Mar 2024 03:01
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Contributors
Author:
Özden Özel Güven
Author:
Meral Bayraktar
Author:
Tuncer Hökelek
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