1-Benzoyl-3,3-dibutyl­thio­urea

The title mol­ecule, C(16)H(24)N(2)OS, is twisted about the central N(H)—C bond with a C—N(H)—C—N torsion angle of −62.67 (15)°. The carbonyl group is twisted out of the plane of the benzene ring, forming a C—C—C=O torsion angle of −25.06 (17)°. In the crystal, mol­ecules related by centres of symme...

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Detalles Bibliográficos
Autores principales: Gunasekaran, N., Karvembu, R., Ng, Seik Weng, Tiekink, Edward R. T.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983357/
https://www.ncbi.nlm.nih.gov/pubmed/21587578
http://dx.doi.org/10.1107/S1600536810037177
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author Gunasekaran, N.
Karvembu, R.
Ng, Seik Weng
Tiekink, Edward R. T.
author_facet Gunasekaran, N.
Karvembu, R.
Ng, Seik Weng
Tiekink, Edward R. T.
author_sort Gunasekaran, N.
collection PubMed
description The title mol­ecule, C(16)H(24)N(2)OS, is twisted about the central N(H)—C bond with a C—N(H)—C—N torsion angle of −62.67 (15)°. The carbonyl group is twisted out of the plane of the benzene ring, forming a C—C—C=O torsion angle of −25.06 (17)°. In the crystal, mol­ecules related by centres of symmetry are linked by pairs of inter­molecular N—H⋯S hydrogen bonds, forming eight-membered {⋯HNCS}(2) synthons. These are further connected by weak via C—H⋯O contacts, forming a two-dimensional array in the bc plane.
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spelling pubmed-29833572010-12-30 1-Benzoyl-3,3-dibutyl­thio­urea Gunasekaran, N. Karvembu, R. Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title mol­ecule, C(16)H(24)N(2)OS, is twisted about the central N(H)—C bond with a C—N(H)—C—N torsion angle of −62.67 (15)°. The carbonyl group is twisted out of the plane of the benzene ring, forming a C—C—C=O torsion angle of −25.06 (17)°. In the crystal, mol­ecules related by centres of symmetry are linked by pairs of inter­molecular N—H⋯S hydrogen bonds, forming eight-membered {⋯HNCS}(2) synthons. These are further connected by weak via C—H⋯O contacts, forming a two-dimensional array in the bc plane. International Union of Crystallography 2010-09-25 /pmc/articles/PMC2983357/ /pubmed/21587578 http://dx.doi.org/10.1107/S1600536810037177 Text en © Gunasekaran et al. 2010 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
Gunasekaran, N.
Karvembu, R.
Ng, Seik Weng
Tiekink, Edward R. T.
1-Benzoyl-3,3-dibutyl­thio­urea
title 1-Benzoyl-3,3-dibutyl­thio­urea
title_full 1-Benzoyl-3,3-dibutyl­thio­urea
title_fullStr 1-Benzoyl-3,3-dibutyl­thio­urea
title_full_unstemmed 1-Benzoyl-3,3-dibutyl­thio­urea
title_short 1-Benzoyl-3,3-dibutyl­thio­urea
title_sort 1-benzoyl-3,3-dibutyl­thio­urea
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983357/
https://www.ncbi.nlm.nih.gov/pubmed/21587578
http://dx.doi.org/10.1107/S1600536810037177
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AT karvembur 1benzoyl33dibutylthiourea
AT ngseikweng 1benzoyl33dibutylthiourea
AT tiekinkedwardrt 1benzoyl33dibutylthiourea

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