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A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis
The title compound, [Au(C(9)H(10)NOS)(C(18)H(15)P)], features a near linear P—Au—S arrangement defined by phosphane P and thiolate S atoms with the minor distortion from the ideal [P—Au—S is 177.61 (2)°] being traced in part to the close intramolecular approach of an O atom [Au⋯O = 3.040 (2) Å]. T...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5050773/ https://www.ncbi.nlm.nih.gov/pubmed/27746938 http://dx.doi.org/10.1107/S2056989016014419 |
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author | Yeo, Chien Ing Tan, Sang Loon Tiekink, Edward R. T. |
author_facet | Yeo, Chien Ing Tan, Sang Loon Tiekink, Edward R. T. |
author_sort | Yeo, Chien Ing |
collection | PubMed |
description | The title compound, [Au(C(9)H(10)NOS)(C(18)H(15)P)], features a near linear P—Au—S arrangement defined by phosphane P and thiolate S atoms with the minor distortion from the ideal [P—Au—S is 177.61 (2)°] being traced in part to the close intramolecular approach of an O atom [Au⋯O = 3.040 (2) Å]. The packing features supramolecular layers lying parallel to (011) sustained by a combination of C—H⋯π and π–π [inter-centroid distance = 3.8033 (17) Å] interactions. The molecular structure and packing are compared with those determined for a previously reported hemi-methanol solvate [Kuan et al. (2008 ▸). CrystEngComm, 10, 548–564]. Relatively minor differences are noted in the conformations of the rings in the Au-containing molecules. A Hirshfeld surface analysis confirms the similarity in the packing with the most notable differences relating to the formation of C—H⋯S contacts between the constituents of the solvate. |
format | Online Article Text |
id | pubmed-5050773 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-50507732016-10-14 A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis Yeo, Chien Ing Tan, Sang Loon Tiekink, Edward R. T. Acta Crystallogr E Crystallogr Commun Research Communications The title compound, [Au(C(9)H(10)NOS)(C(18)H(15)P)], features a near linear P—Au—S arrangement defined by phosphane P and thiolate S atoms with the minor distortion from the ideal [P—Au—S is 177.61 (2)°] being traced in part to the close intramolecular approach of an O atom [Au⋯O = 3.040 (2) Å]. The packing features supramolecular layers lying parallel to (011) sustained by a combination of C—H⋯π and π–π [inter-centroid distance = 3.8033 (17) Å] interactions. The molecular structure and packing are compared with those determined for a previously reported hemi-methanol solvate [Kuan et al. (2008 ▸). CrystEngComm, 10, 548–564]. Relatively minor differences are noted in the conformations of the rings in the Au-containing molecules. A Hirshfeld surface analysis confirms the similarity in the packing with the most notable differences relating to the formation of C—H⋯S contacts between the constituents of the solvate. International Union of Crystallography 2016-09-16 /pmc/articles/PMC5050773/ /pubmed/27746938 http://dx.doi.org/10.1107/S2056989016014419 Text en © Yeo et al. 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 Yeo, Chien Ing Tan, Sang Loon Tiekink, Edward R. T. A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis |
title | A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis |
title_full | A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis |
title_fullStr | A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis |
title_full_unstemmed | A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis |
title_short | A non-solvated form of [(Z)-O-methyl-N-(2-methylphenyl)thiocarbamato-κS](triphenylphosphane-κP)gold(I): crystal structure and Hirshfeld surface analysis |
title_sort | non-solvated form of [(z)-o-methyl-n-(2-methylphenyl)thiocarbamato-κs](triphenylphosphane-κp)gold(i): crystal structure and hirshfeld surface analysis |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5050773/ https://www.ncbi.nlm.nih.gov/pubmed/27746938 http://dx.doi.org/10.1107/S2056989016014419 |
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