Acta Crystallographica Section E (Jun 2011)

Tetraaquabis[4-(4H-1,2,4-triazol-4-yl)benzoato-κN1]copper(II) dihydrate

  • Shuzhi Xu,
  • Wenxin Shao,
  • Miao Yu,
  • Guihua Gong

DOI
https://doi.org/10.1107/S1600536811018356
Journal volume & issue
Vol. 67, no. 6
pp. m777 – m777

Abstract

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In the title compound, [Cu(C9H6N3O2)2(H2O)4]·2H2O, the CuII atom lies on an inversion center and is six-coordinated by two N atoms from two 4-(1,2,4-triazol-4-yl)benzoate ligands and four water molecules in a distorted octahedral geometry. In the crystal, intermolecular O—H...O hydrogen bonds lead to a three-dimensional supramolecular network. Intramolecular O—H...N hydrogen bonds and π–π interactions between the benzene rings and between the benzene and triazole rings [centroid–centroid distances = 3.657 (1) and 3.752 (1) Å] are observed.