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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...
Autores principales: | , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2010
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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. |
format | Text |
id | pubmed-2979108 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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