3,5-Bis(4-methoxy-phen-yl)-1H-1,2,4-triazole monohydrate.

Acta Crystallogr Sect E Struct Rep Online

College of Chemistry, Chemical Engineering and Materials Science, Shandong Normal University, Jinan 250014, People's Republic of China.

Published: May 2009

In the title compound, C(16)H(15)N(3)O(2)·H(2)O, the two benzene rings and the triazole ring lie almost in the same plane, the triazole ring forming dihedral angles of 5.07 (9) and 5.80 (8)° with the benzene rings. In the crystal, there are three relatively strong inter-molecular O-H⋯N and N-H⋯O hydrogen bonds, which lead to the formation of a one-dimensional double chain running parallel to the a axis. Weak π-π inter-actions between the benzene rings of neighboring chains with a centroid-centroid distance of 3.893 (4) Å result in the formation of layers parallel to the ac plane.

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Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969559PMC
http://dx.doi.org/10.1107/S160053680901695XDOI Listing

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