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. 2011 Dec 1;67(Pt 12):o3422-3.
doi: 10.1107/S1600536811048653. Epub 2011 Nov 25.

4-(3-Chloro-phen-yl)-3-[(2,6-difluoro-benz-yl)sulfan-yl]-5-(3,4,5-trimeth-oxy-phen-yl)-4H-1,2,4-triazole

Hoong-Kun Fun, Safra Izuani Jama Asik, B Chandrakantha, Arun M Isloor, Prakash Shetty

4-(3-Chloro-phen-yl)-3-[(2,6-difluoro-benz-yl)sulfan-yl]-5-(3,4,5-trimeth-oxy-phen-yl)-4H-1,2,4-triazole

Hoong-Kun Fun et al. Acta Crystallogr Sect E Struct Rep Online. .

Abstract

In the title compound, C(24)H(20)ClF(2)N(3)O(3)S, the essentially planar triazole ring (r.m.s. deviation = 0.001 Å) forms dihedral angles of 22.35 (10), 68.17 (10) and 42.01 (10)° with the mean planes of the trimeth-oxy-phenyl, chloro-phenyl and difluoro-phenyl rings, respectively. A weak intra-molecular C-H⋯π inter-action occurs. In the crystal, mol-ecules are linked into sheets lying parallel to the bc plane by C-H⋯O and C-H⋯N hydrogen bonds. The crystal packing also features weak C-H⋯π inter-actions.

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Figures

Fig. 1.
Fig. 1.
The structure of the title compound, showing 50% probability displacement ellipsoids. Hydrogen atoms are shown as spheres of arbitrary radius.
Fig. 2.
Fig. 2.
The crystal packing, viewed along the a-axis, showing two-dimensional planes parallel to bc plane. Hydrogen atoms that not involved in hydrogen bonding (dashed lines) are omitted for clarity.
See this image and copyright information in PMC

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