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O-Propyl N-phenylthiocarbamate
Two independent molecules comprise the asymmetric unit in the title thiocarbamide derivative, C(10)H(13)NOS. These differ in the relative orientations of terminal ethyl groups [C—C—C—O torsion angles = −66.95 (13) and 55.92 (13)°, respectively]. The phenyl ring is twisted out of the plane of the c...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379354/ https://www.ncbi.nlm.nih.gov/pubmed/22719552 http://dx.doi.org/10.1107/S160053681202140X |
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author | Sudkaow, Panyapon Yeo, Chien Ing Ng, Seik Weng Tiekink, Edward R. T. |
author_facet | Sudkaow, Panyapon Yeo, Chien Ing Ng, Seik Weng Tiekink, Edward R. T. |
author_sort | Sudkaow, Panyapon |
collection | PubMed |
description | Two independent molecules comprise the asymmetric unit in the title thiocarbamide derivative, C(10)H(13)NOS. These differ in the relative orientations of terminal ethyl groups [C—C—C—O torsion angles = −66.95 (13) and 55.92 (13)°, respectively]. The phenyl ring is twisted out of the plane of the central residue [C(q)—N—C(ph)—C(ph) = −146.20 (12) and −144.15 (12)°, respectively; q = quaternary and ph = phenyl]. The independent molecules are linked into a dimeric aggregate by N—H⋯S hydrogen bonds and an eight-membered thioamide {⋯H—N—C=S}(2) synthon. |
format | Online Article Text |
id | pubmed-3379354 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33793542012-06-20 O-Propyl N-phenylthiocarbamate Sudkaow, Panyapon Yeo, Chien Ing Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers Two independent molecules comprise the asymmetric unit in the title thiocarbamide derivative, C(10)H(13)NOS. These differ in the relative orientations of terminal ethyl groups [C—C—C—O torsion angles = −66.95 (13) and 55.92 (13)°, respectively]. The phenyl ring is twisted out of the plane of the central residue [C(q)—N—C(ph)—C(ph) = −146.20 (12) and −144.15 (12)°, respectively; q = quaternary and ph = phenyl]. The independent molecules are linked into a dimeric aggregate by N—H⋯S hydrogen bonds and an eight-membered thioamide {⋯H—N—C=S}(2) synthon. International Union of Crystallography 2012-05-19 /pmc/articles/PMC3379354/ /pubmed/22719552 http://dx.doi.org/10.1107/S160053681202140X Text en © Sudkaow et al. 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 | Organic Papers Sudkaow, Panyapon Yeo, Chien Ing Ng, Seik Weng Tiekink, Edward R. T. O-Propyl N-phenylthiocarbamate |
title |
O-Propyl N-phenylthiocarbamate |
title_full |
O-Propyl N-phenylthiocarbamate |
title_fullStr |
O-Propyl N-phenylthiocarbamate |
title_full_unstemmed |
O-Propyl N-phenylthiocarbamate |
title_short |
O-Propyl N-phenylthiocarbamate |
title_sort | o-propyl n-phenylthiocarbamate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379354/ https://www.ncbi.nlm.nih.gov/pubmed/22719552 http://dx.doi.org/10.1107/S160053681202140X |
work_keys_str_mv | AT sudkaowpanyapon opropylnphenylthiocarbamate AT yeochiening opropylnphenylthiocarbamate AT ngseikweng opropylnphenylthiocarbamate AT tiekinkedwardrt opropylnphenylthiocarbamate |