1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea

The asymmetric unit of the title compound, C(11)H(12)BrClN(2)OS, consists of two crystallographically independent mol­ecules. In each mol­ecule, the butano­ylthio­urea unit is nearly planar, with maximum deviations of 0.1292 (19) and 0.3352 (18) Å from the mean plane defined by nine non-H atoms, and...

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Autores principales: Yusof, Mohd Sukeri Mohd, Embong, Nur Farhana, Arshad, Suhana, Razak, Ibrahim Abdul
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344192/
https://www.ncbi.nlm.nih.gov/pubmed/22606195
http://dx.doi.org/10.1107/S160053681201327X
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author Yusof, Mohd Sukeri Mohd
Embong, Nur Farhana
Arshad, Suhana
Razak, Ibrahim Abdul
author_facet Yusof, Mohd Sukeri Mohd
Embong, Nur Farhana
Arshad, Suhana
Razak, Ibrahim Abdul
author_sort Yusof, Mohd Sukeri Mohd
collection PubMed
description The asymmetric unit of the title compound, C(11)H(12)BrClN(2)OS, consists of two crystallographically independent mol­ecules. In each mol­ecule, the butano­ylthio­urea unit is nearly planar, with maximum deviations of 0.1292 (19) and 0.3352 (18) Å from the mean plane defined by nine non-H atoms, and is twisted relative to the terminal benzene ring with dihedral angles of 69.26 (7) and 82.41 (7)°. An intra­molecular N—H⋯O hydrogen bond generates an S(6) ring motif in each butano­ylthio­urea unit. In the crystal, N—H⋯O hydrogen bonds link the two independent mol­ecules together, forming an R (2) (2)(12) ring motif. The mol­ecules are further connected into a tape along the c axis via N—H⋯S and C—H⋯S hydrogen bonds.
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spelling pubmed-33441922012-05-17 1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea Yusof, Mohd Sukeri Mohd Embong, Nur Farhana Arshad, Suhana Razak, Ibrahim Abdul Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(11)H(12)BrClN(2)OS, consists of two crystallographically independent mol­ecules. In each mol­ecule, the butano­ylthio­urea unit is nearly planar, with maximum deviations of 0.1292 (19) and 0.3352 (18) Å from the mean plane defined by nine non-H atoms, and is twisted relative to the terminal benzene ring with dihedral angles of 69.26 (7) and 82.41 (7)°. An intra­molecular N—H⋯O hydrogen bond generates an S(6) ring motif in each butano­ylthio­urea unit. In the crystal, N—H⋯O hydrogen bonds link the two independent mol­ecules together, forming an R (2) (2)(12) ring motif. The mol­ecules are further connected into a tape along the c axis via N—H⋯S and C—H⋯S hydrogen bonds. International Union of Crystallography 2012-03-31 /pmc/articles/PMC3344192/ /pubmed/22606195 http://dx.doi.org/10.1107/S160053681201327X Text en © Yusof 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
Yusof, Mohd Sukeri Mohd
Embong, Nur Farhana
Arshad, Suhana
Razak, Ibrahim Abdul
1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea
title 1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea
title_full 1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea
title_fullStr 1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea
title_full_unstemmed 1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea
title_short 1-(2-Bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea
title_sort 1-(2-bromo­phen­yl)-3-(4-chloro­butano­yl)thio­urea
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344192/
https://www.ncbi.nlm.nih.gov/pubmed/22606195
http://dx.doi.org/10.1107/S160053681201327X
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AT razakibrahimabdul 12bromophenyl34chlorobutanoylthiourea

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