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Crystal structure of cis-aqua­chlorido­(rac-5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane-κ(4) N)chromium(III) tetra­chlorido­zincate trihydrate from synchrotron data

The structure of the title compound, cis-[CrCl(cycb)(H(2)O)][ZnCl(4)]·3H(2)O (cycb is rac-5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane; C(16)H(36)N(4)), has been determined from synchrotron data. In the complex cation, the Cr(III) ion is bound by four N atoms from the tetra­denta...

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Detalles Bibliográficos
Autores principales: Moon, Dohyun, Choi, Jong-Ha
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4555385/
https://www.ncbi.nlm.nih.gov/pubmed/26396846
http://dx.doi.org/10.1107/S2056989015015212
Descripción
Sumario:The structure of the title compound, cis-[CrCl(cycb)(H(2)O)][ZnCl(4)]·3H(2)O (cycb is rac-5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane; C(16)H(36)N(4)), has been determined from synchrotron data. In the complex cation, the Cr(III) ion is bound by four N atoms from the tetra­dentate cycb ligand, a chloride ion and one water mol­ecule in a cis arrangement, displaying a distorted octa­hedral coordination geometry. The distorted tetra­hedral [ZnCl(4)](2−) anion and three additional water mol­ecules remain outside the coordination sphere. The Cr—N(cycb) bond lengths are in the range of 2.0837 (14) to 2.1399 (12) Å while the Cr—Cl and Cr—(OH(2)) bond lengths are 2.2940 (8) and 2.0082 (13) Å, respectively. The crystal packing is stabilized by hydrogen-bonding inter­actions between the N—H groups of the macrocyclic ligand, the O—H groups of the water mol­ecules and the Cl atoms of the tetra­chlorido­zincate anion, leading to the formation of a three-dimensional network.