Abstract

The title complex, tetra­aqua­{1-[(1H-benzotriazol-1-yl)meth­yl]-1H-1,2,4-triazole-κN 4}(sulfato-κO)copper(II) sesquihydrate, [Cu(SO4)(C9H8N6)(H2O)4]·1.5H2O, is composed of one copper atom, one 1-[(2H-benzotriazol-1-yl)meth­yl]-1-H-1,2,4-triazole (bmt) ligand, one sulfate ligand, four coordin­ated water mol­ecules and one and a half uncoordinated water mol­ecules. The CuII atom is six-coordinated by one N atom from a bmt ligand and five O atoms from the monodentate sulfate ligand and four water mol­ecules in a distorted octa­hedral geometry. In the crystal, adjacent mol­ecules are linked through O—H⋯O and O—H⋯N hydrogen bonds involving the sulfate anion and the coordin­ated and uncoordinated water mol­ecules into a three-dimensional network.

Highlights

  • The title complex, tetraaqua{1-[(1H-benzotriazol-1-yl)methyl]1H-1,2,4-triazole-N4}(sulfato-O)copper(II) sesquihydrate, [Cu(SO4)(C9H8N6)(H2O)4]Á1.5H2O, is composed of one copper atom, one 1-[(2H-benzotriazol-1-yl)methyl]-1-H1,2,4-triazole ligand, one sulfate ligand, four coordinated water molecules and one and a half uncoordinated water molecules

  • The CuII atom is six-coordinated by one N atom from a bmt ligand and five O atoms from the monodentate sulfate ligand and four water molecules in a distorted octahedral geometry

  • Adjacent molecules are linked through O—HÁ Á ÁO and O—HÁ Á ÁN hydrogen bonds involving the sulfate anion and the coordinated and uncoordinated water molecules into a three-dimensional network

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Summary

Structure Reports Online

A new copper(II) complex based on 1-[(1H-benzotriazol-1-yl)methyl]-1H1,2,4-triazole. The title complex, tetraaqua{1-[(1H-benzotriazol-1-yl)methyl]1H-1,2,4-triazole-N4}(sulfato-O)copper(II) sesquihydrate, [Cu(SO4)(C9H8N6)(H2O)4]Á1.5H2O, is composed of one copper atom, one 1-[(2H-benzotriazol-1-yl)methyl]-1-H1,2,4-triazole (bmt) ligand, one sulfate ligand, four coordinated water molecules and one and a half uncoordinated water molecules. The CuII atom is six-coordinated by one N atom from a bmt ligand and five O atoms from the monodentate sulfate ligand and four water molecules in a distorted octahedral geometry. Adjacent molecules are linked through O—HÁ Á ÁO and O—HÁ Á ÁN hydrogen bonds involving the sulfate anion and the coordinated and uncoordinated water molecules into a three-dimensional network. Related literature For background to complexes based on triazole and benzotriazole derivatives, see: Aromia et al (2011); Meng et al (2009).

Data collection
DÁ Á ÁA
Rigaku Saturn diffractometer
Special details
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