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Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data

The structure of the title double salt, [Cr(rac-chxn)(3)][ZnCl(4)]Cl·3H(2)O (chxn is trans-1,2-cyclo­hexa­nedi­amine; C(6)H(14)N(2)), has been determined from synchrotron data. The Cr(III) ion is coordinated by six N atoms of three chelating chxn ligands, displaying a slightly distorted octa­hedral...

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Autores principales: Moon, Dohyun, Choi, Jong-Ha
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4908525/
https://www.ncbi.nlm.nih.gov/pubmed/27308016
http://dx.doi.org/10.1107/S2056989016005788
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author Moon, Dohyun
Choi, Jong-Ha
author_facet Moon, Dohyun
Choi, Jong-Ha
author_sort Moon, Dohyun
collection PubMed
description The structure of the title double salt, [Cr(rac-chxn)(3)][ZnCl(4)]Cl·3H(2)O (chxn is trans-1,2-cyclo­hexa­nedi­amine; C(6)H(14)N(2)), has been determined from synchrotron data. The Cr(III) ion is coordinated by six N atoms of three chelating chxn ligands, displaying a slightly distorted octa­hedral coordination environment. The distorted tetra­hedral [ZnCl(4)](2−) anion, the isolated Cl(−) anion and three lattice water mol­ecules remain outside the coordination sphere. The Cr—N(chxn) bond lengths are in a narrow range between 2.0737 (12) and 2.0928 (12) Å; the mean N—Cr—N bite angle is 82.1 (4)°. The crystal packing is stabilized by hydrogen-bonding inter­actions between the amino groups of the chxn ligands and the water mol­ecules as donor groups, and O atoms of the water mol­ecules, chloride anions and Cl atoms of the [ZnCl(4)](2−) anions as acceptor groups, leading to the formation of a three-dimensional network. The [ZnCl(4)](2−) anion is disordered over two sets of sites with an occupancy ratio of 0.94:0.06.
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spelling pubmed-49085252016-06-15 Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data Moon, Dohyun Choi, Jong-Ha Acta Crystallogr E Crystallogr Commun Research Communications The structure of the title double salt, [Cr(rac-chxn)(3)][ZnCl(4)]Cl·3H(2)O (chxn is trans-1,2-cyclo­hexa­nedi­amine; C(6)H(14)N(2)), has been determined from synchrotron data. The Cr(III) ion is coordinated by six N atoms of three chelating chxn ligands, displaying a slightly distorted octa­hedral coordination environment. The distorted tetra­hedral [ZnCl(4)](2−) anion, the isolated Cl(−) anion and three lattice water mol­ecules remain outside the coordination sphere. The Cr—N(chxn) bond lengths are in a narrow range between 2.0737 (12) and 2.0928 (12) Å; the mean N—Cr—N bite angle is 82.1 (4)°. The crystal packing is stabilized by hydrogen-bonding inter­actions between the amino groups of the chxn ligands and the water mol­ecules as donor groups, and O atoms of the water mol­ecules, chloride anions and Cl atoms of the [ZnCl(4)](2−) anions as acceptor groups, leading to the formation of a three-dimensional network. The [ZnCl(4)](2−) anion is disordered over two sets of sites with an occupancy ratio of 0.94:0.06. International Union of Crystallography 2016-04-12 /pmc/articles/PMC4908525/ /pubmed/27308016 http://dx.doi.org/10.1107/S2056989016005788 Text en © Moon and Choi 2016 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Research Communications
Moon, Dohyun
Choi, Jong-Ha
Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data
title Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data
title_full Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data
title_fullStr Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data
title_full_unstemmed Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data
title_short Crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) N,N′)chromium(III) tetra­chlorido­zincate chloride trihydrate from synchrotron data
title_sort crystal structure of tris­(trans-1,2-cyclo­hexa­ne­diamine-κ(2) n,n′)chromium(iii) tetra­chlorido­zincate chloride trihydrate from synchrotron data
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4908525/
https://www.ncbi.nlm.nih.gov/pubmed/27308016
http://dx.doi.org/10.1107/S2056989016005788
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