Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I)

The mol­ecular structure of the title compound, [CuCl(C(7)H(12)N(2)S)(2)], shows a slightly distorted trigonal–planar coordination geometry of the Cu atom. The Cu—Cl bond measures 2.2287 (9) Å, and the two Cu—S bonds are significantly different from each other, with values of 2.2270 (10) and 2.2662 ...

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Autores principales: Flörke, Ulrich, Ahmida, Aziza, Egold, Hans, Henkel, Gerald
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257435/
https://www.ncbi.nlm.nih.gov/pubmed/25553008
http://dx.doi.org/10.1107/S1600536814024404
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author Flörke, Ulrich
Ahmida, Aziza
Egold, Hans
Henkel, Gerald
author_facet Flörke, Ulrich
Ahmida, Aziza
Egold, Hans
Henkel, Gerald
author_sort Flörke, Ulrich
collection PubMed
description The mol­ecular structure of the title compound, [CuCl(C(7)H(12)N(2)S)(2)], shows a slightly distorted trigonal–planar coordination geometry of the Cu atom. The Cu—Cl bond measures 2.2287 (9) Å, and the two Cu—S bonds are significantly different from each other, with values of 2.2270 (10) and 2.2662 (10) Å. Also, the S—Cu—Cl angles differ, with values of 113.80 (4) and 124.42 (4)°, while the S—Cu—S angle is 121.51 (4)°. The two imidazole rings are almost parallel, making a dihedral angle of 2.1 (2)°. In the crystal, the shortest C—H⋯Cl interactions stabilize a three-dimensional network with molecules linked into centrosymmetric dimers that are stacked along the b-axis direction.
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spelling pubmed-42574352014-12-31 Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I) Flörke, Ulrich Ahmida, Aziza Egold, Hans Henkel, Gerald Acta Crystallogr Sect E Struct Rep Online Data Reports The mol­ecular structure of the title compound, [CuCl(C(7)H(12)N(2)S)(2)], shows a slightly distorted trigonal–planar coordination geometry of the Cu atom. The Cu—Cl bond measures 2.2287 (9) Å, and the two Cu—S bonds are significantly different from each other, with values of 2.2270 (10) and 2.2662 (10) Å. Also, the S—Cu—Cl angles differ, with values of 113.80 (4) and 124.42 (4)°, while the S—Cu—S angle is 121.51 (4)°. The two imidazole rings are almost parallel, making a dihedral angle of 2.1 (2)°. In the crystal, the shortest C—H⋯Cl interactions stabilize a three-dimensional network with molecules linked into centrosymmetric dimers that are stacked along the b-axis direction. International Union of Crystallography 2014-11-15 /pmc/articles/PMC4257435/ /pubmed/25553008 http://dx.doi.org/10.1107/S1600536814024404 Text en © Flörke et al. 2014 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 Data Reports
Flörke, Ulrich
Ahmida, Aziza
Egold, Hans
Henkel, Gerald
Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I)
title Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I)
title_full Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I)
title_fullStr Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I)
title_full_unstemmed Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I)
title_short Crystal structure of bis­[1,3,4,5-tetra­methyl-1H-imidazole-2(3H)-thione-κS]chlorido­copper(I)
title_sort crystal structure of bis­[1,3,4,5-tetra­methyl-1h-imidazole-2(3h)-thione-κs]chlorido­copper(i)
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257435/
https://www.ncbi.nlm.nih.gov/pubmed/25553008
http://dx.doi.org/10.1107/S1600536814024404
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AT henkelgerald crystalstructureofbis1345tetramethyl1himidazole23hthionekschloridocopperi

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