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Crystal structure of poly[(μ(3)-thiocyanato-κ(3) N:S:S)(trimethylphosphine sulfide-κS)copper(I)]
In the title compound, [Cu(NCS)(C(3)H(9)PS)](n), the thiocyanate ions bind the Cu(I) atoms covalently, forming infinite –Cu—SCN—Cu– chains parallel to the a axis. Each Cu(I) atom is also coordinated to a trimethylphosphine sulfide group via a Cu—S bond. Two crystallographically independent chains...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2014
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257289/ https://www.ncbi.nlm.nih.gov/pubmed/25484723 http://dx.doi.org/10.1107/S1600536814021412 |
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author | Corfield, Peter W. R. |
author_facet | Corfield, Peter W. R. |
author_sort | Corfield, Peter W. R. |
collection | PubMed |
description | In the title compound, [Cu(NCS)(C(3)H(9)PS)](n), the thiocyanate ions bind the Cu(I) atoms covalently, forming infinite –Cu—SCN—Cu– chains parallel to the a axis. Each Cu(I) atom is also coordinated to a trimethylphosphine sulfide group via a Cu—S bond. Two crystallographically independent chains propagate in opposite directions, and are held together in a ribbon arrangement by long bonds between Cu(I) atoms in the first chain and thiocyanate S atoms in the second, with Cu—S = 2.621 (1) Å. The geometry around the Cu(I) atoms in the first chain is distorted tetrahedral, with angles involving the long Cu—S bond much less than ideal, and the S—Cu—N angle between the phosphine sulfide S atom and the thiocyanate N atom opening out to 133.19 (9)°. Each Cu(I) atom in the second chain appears to be disordered between two positions 0.524 (4) Å apart, with occupancy factors of 0.647 (6) and 0.353 (6). The Cu(I) atom in the major site is in a distorted trigonal–planar configuration, with the S—Cu—N angle between the phosphine sulfide and the thiocyanate N atom again opened out, to 137.01 (15)°. The Cu(I) atom in the minor site, however, forms in addition a long bond [Cu—S = 2.702 (5) Å] to the phosphine sulfide of the first chain, not the thiocyanate S atom, to provide a further link between the chains. |
format | Online Article Text |
id | pubmed-4257289 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-42572892014-12-05 Crystal structure of poly[(μ(3)-thiocyanato-κ(3) N:S:S)(trimethylphosphine sulfide-κS)copper(I)] Corfield, Peter W. R. Acta Crystallogr Sect E Struct Rep Online Research Communications In the title compound, [Cu(NCS)(C(3)H(9)PS)](n), the thiocyanate ions bind the Cu(I) atoms covalently, forming infinite –Cu—SCN—Cu– chains parallel to the a axis. Each Cu(I) atom is also coordinated to a trimethylphosphine sulfide group via a Cu—S bond. Two crystallographically independent chains propagate in opposite directions, and are held together in a ribbon arrangement by long bonds between Cu(I) atoms in the first chain and thiocyanate S atoms in the second, with Cu—S = 2.621 (1) Å. The geometry around the Cu(I) atoms in the first chain is distorted tetrahedral, with angles involving the long Cu—S bond much less than ideal, and the S—Cu—N angle between the phosphine sulfide S atom and the thiocyanate N atom opening out to 133.19 (9)°. Each Cu(I) atom in the second chain appears to be disordered between two positions 0.524 (4) Å apart, with occupancy factors of 0.647 (6) and 0.353 (6). The Cu(I) atom in the major site is in a distorted trigonal–planar configuration, with the S—Cu—N angle between the phosphine sulfide and the thiocyanate N atom again opened out, to 137.01 (15)°. The Cu(I) atom in the minor site, however, forms in addition a long bond [Cu—S = 2.702 (5) Å] to the phosphine sulfide of the first chain, not the thiocyanate S atom, to provide a further link between the chains. International Union of Crystallography 2014-10-04 /pmc/articles/PMC4257289/ /pubmed/25484723 http://dx.doi.org/10.1107/S1600536814021412 Text en © Peter W. R. Corfield 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 | Research Communications Corfield, Peter W. R. Crystal structure of poly[(μ(3)-thiocyanato-κ(3) N:S:S)(trimethylphosphine sulfide-κS)copper(I)] |
title | Crystal structure of poly[(μ(3)-thiocyanato-κ(3)
N:S:S)(trimethylphosphine sulfide-κS)copper(I)] |
title_full | Crystal structure of poly[(μ(3)-thiocyanato-κ(3)
N:S:S)(trimethylphosphine sulfide-κS)copper(I)] |
title_fullStr | Crystal structure of poly[(μ(3)-thiocyanato-κ(3)
N:S:S)(trimethylphosphine sulfide-κS)copper(I)] |
title_full_unstemmed | Crystal structure of poly[(μ(3)-thiocyanato-κ(3)
N:S:S)(trimethylphosphine sulfide-κS)copper(I)] |
title_short | Crystal structure of poly[(μ(3)-thiocyanato-κ(3)
N:S:S)(trimethylphosphine sulfide-κS)copper(I)] |
title_sort | crystal structure of poly[(μ(3)-thiocyanato-κ(3)
n:s:s)(trimethylphosphine sulfide-κs)copper(i)] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257289/ https://www.ncbi.nlm.nih.gov/pubmed/25484723 http://dx.doi.org/10.1107/S1600536814021412 |
work_keys_str_mv | AT corfieldpeterwr crystalstructureofpolym3thiocyanatok3nsstrimethylphosphinesulfidekscopperi |