3-Methyl-sulfanyl-5-phenyl-4H-1,2,4-triazol-4-amine-water (6/1)

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Abstract

In the title compound, 6C9H10N4S· H2O, the dihedral angle between the five-membered triazole ring and the phenyl ring is 44.33 (16)°. The solvent water molecule is disordered about a special position with 3̄ symmetry and its occupancy cannot be greater than 0.1667. The crystal structure is stabilized by inter-molecular N - H⋯N and C-H⋯N hydrogen bonds. © 2009.

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Wu, D. Z., Liu, M. C., Wu, H. Y., Huang, X. B., & Li, J. J. (2009). 3-Methyl-sulfanyl-5-phenyl-4H-1,2,4-triazol-4-amine-water (6/1). Acta Crystallographica Section E: Structure Reports Online, 65(4). https://doi.org/10.1107/S1600536808041056

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