4-[2-(4-Methoxyphenyl)ethyl]-3-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-5(4H)-one monohydrate


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GURUMOORTHY A., GOPALSAMY V., Ramamurthi K., UNLUER D., ÇELİK F.

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, vol.67, 2011 (Peer-Reviewed Journal) identifier identifier identifier

  • Publication Type: Article / Article
  • Volume: 67
  • Publication Date: 2011
  • Doi Number: 10.1107/s1600536811045508
  • Journal Name: ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS
  • Journal Indexes: Science Citation Index Expanded, Emerging Sources Citation Index, Scopus

Abstract

In the title compound, C16H17N3O2S center dot H2O, the triazole ring makes a dihedral angle of 34.63 (6)degrees with the benzene ring. The thiophene ring is disordered over two orientations [occupancy ratio = 0.634 (4):0.366 (4)] which make dihedral angles of 54.61 (16) and 54.57 (31)degrees with the triazole ring. Intermolecular N-H center dot center dot center dot O and O-H center dot center dot center dot O hydrogen bonds stabilize the crystal structure.