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N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea

In the title compound, C(14)H(17)N(3)O(3)S, the nitro group is twisted slightly by 2.6 (3)° from the benzene ring plane and the thio­ureido group makes a dihedral angle of 52.06 (4)° with the benzene ring. The cyclo­hexyl ring displays a chair conformation. An intra­molecular N—H⋯O inter­action is p...

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Detalles Bibliográficos
Autores principales: Saeed, Sohail, Rashid, Naghmana, Wong, Wing-Tak
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979108/
https://www.ncbi.nlm.nih.gov/pubmed/21579095
http://dx.doi.org/10.1107/S1600536810012249
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author Saeed, Sohail
Rashid, Naghmana
Wong, Wing-Tak
author_facet Saeed, Sohail
Rashid, Naghmana
Wong, Wing-Tak
author_sort Saeed, Sohail
collection PubMed
description In the title compound, C(14)H(17)N(3)O(3)S, the nitro group is twisted slightly by 2.6 (3)° from the benzene ring plane and the thio­ureido group makes a dihedral angle of 52.06 (4)° with the benzene ring. The cyclo­hexyl ring displays a chair conformation. An intra­molecular N—H⋯O inter­action is present. In the crystal, inter­molecular N—H⋯S hydrogen bonds link the mol­ecules into centrosymmetric dimers. π–π inter­actions between inversion-related benzene rings (centroid–centroid distance = 4.044 Å) and C—H⋯π inter­actions (H⋯centroid distance = 3.116 Å) between one methyl­ene cyclo­hexyl H atom and the benzene ring are also present.
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spelling pubmed-29791082010-12-30 N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea Saeed, Sohail Rashid, Naghmana Wong, Wing-Tak Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(14)H(17)N(3)O(3)S, the nitro group is twisted slightly by 2.6 (3)° from the benzene ring plane and the thio­ureido group makes a dihedral angle of 52.06 (4)° with the benzene ring. The cyclo­hexyl ring displays a chair conformation. An intra­molecular N—H⋯O inter­action is present. In the crystal, inter­molecular N—H⋯S hydrogen bonds link the mol­ecules into centrosymmetric dimers. π–π inter­actions between inversion-related benzene rings (centroid–centroid distance = 4.044 Å) and C—H⋯π inter­actions (H⋯centroid distance = 3.116 Å) between one methyl­ene cyclo­hexyl H atom and the benzene ring are also present. International Union of Crystallography 2010-04-10 /pmc/articles/PMC2979108/ /pubmed/21579095 http://dx.doi.org/10.1107/S1600536810012249 Text en © Saeed 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
Saeed, Sohail
Rashid, Naghmana
Wong, Wing-Tak
N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea
title N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea
title_full N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea
title_fullStr N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea
title_full_unstemmed N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea
title_short N-Cyclo­hexyl-N′-(4-nitro­benzo­yl)thio­urea
title_sort n-cyclo­hexyl-n′-(4-nitro­benzo­yl)thio­urea
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979108/
https://www.ncbi.nlm.nih.gov/pubmed/21579095
http://dx.doi.org/10.1107/S1600536810012249
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