Cargando…
Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2) S:S] at 100 K
The structure of the polymeric title compound, [CuCl(CH(4)N(2)S)(2)](n), has been redetermined to modern standards of precision with anisotropic refinement and location of the H atoms. The previous structure report [Spofford & Amma (1970 ▶). Acta Cryst. B26, 1474–1483] is generally confirmed to...
Autor principal: | |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297225/ https://www.ncbi.nlm.nih.gov/pubmed/22412415 http://dx.doi.org/10.1107/S1600536812004448 |
_version_ | 1782225843233226752 |
---|---|
author | Zouihri, Hafid |
author_facet | Zouihri, Hafid |
author_sort | Zouihri, Hafid |
collection | PubMed |
description | The structure of the polymeric title compound, [CuCl(CH(4)N(2)S)(2)](n), has been redetermined to modern standards of precision with anisotropic refinement and location of the H atoms. The previous structure report [Spofford & Amma (1970 ▶). Acta Cryst. B26, 1474–1483] is generally confirmed to higher precision [typical Cu—S bond length s.u. values = 0.005 (old) and 0.001 Å (new)]. The asymmetric unit contains two formula units, with both Cu(I) atoms coordinated by one terminal S atom and two bridging S atoms of thiourea ligands. This connectivity leads to polymeric [100] chains in the crystal. If very long contacts to nearby chloride ions [2.8687 (9) and 3.1394 (12) Å] are considered to be bonding, then very distorted CuS(3)Cl tetrahedral coordination polyhedra arise. The crystal structure is consolidated by weak intra- and inter-chain N—H⋯S and N—H⋯Cl hydrogen bonds. |
format | Online Article Text |
id | pubmed-3297225 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32972252012-03-12 Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2) S:S] at 100 K Zouihri, Hafid Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The structure of the polymeric title compound, [CuCl(CH(4)N(2)S)(2)](n), has been redetermined to modern standards of precision with anisotropic refinement and location of the H atoms. The previous structure report [Spofford & Amma (1970 ▶). Acta Cryst. B26, 1474–1483] is generally confirmed to higher precision [typical Cu—S bond length s.u. values = 0.005 (old) and 0.001 Å (new)]. The asymmetric unit contains two formula units, with both Cu(I) atoms coordinated by one terminal S atom and two bridging S atoms of thiourea ligands. This connectivity leads to polymeric [100] chains in the crystal. If very long contacts to nearby chloride ions [2.8687 (9) and 3.1394 (12) Å] are considered to be bonding, then very distorted CuS(3)Cl tetrahedral coordination polyhedra arise. The crystal structure is consolidated by weak intra- and inter-chain N—H⋯S and N—H⋯Cl hydrogen bonds. International Union of Crystallography 2012-02-10 /pmc/articles/PMC3297225/ /pubmed/22412415 http://dx.doi.org/10.1107/S1600536812004448 Text en © Hafid Zouihri 2012 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 | Metal-Organic Papers Zouihri, Hafid Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2) S:S] at 100 K |
title | Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2)
S:S] at 100 K |
title_full | Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2)
S:S] at 100 K |
title_fullStr | Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2)
S:S] at 100 K |
title_full_unstemmed | Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2)
S:S] at 100 K |
title_short | Redetermination of catena-poly[[chlorido(thiourea-κS)copper(I)]-μ-thiourea-κ(2)
S:S] at 100 K |
title_sort | redetermination of catena-poly[[chlorido(thiourea-κs)copper(i)]-μ-thiourea-κ(2)
s:s] at 100 k |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297225/ https://www.ncbi.nlm.nih.gov/pubmed/22412415 http://dx.doi.org/10.1107/S1600536812004448 |
work_keys_str_mv | AT zouihrihafid redeterminationofcatenapolychloridothioureakscopperimthioureak2ssat100k |