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Crystal structure of 1-(2-aminophenyl)-3-phenylurea
In the title compound, C(13)H(13)N(3)O, the phenyl ring makes a dihedral angle of 47.0 (1)° with the mean plane of the –NC(=O)N– unit, while the dihedral angle between the latter mean plane and the aminophenyl ring is 84.43 (7)°. In the crystal, molecules are linked via N—H⋯O hydrogen bonds involv...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384537/ https://www.ncbi.nlm.nih.gov/pubmed/25878886 http://dx.doi.org/10.1107/S2056989014028175 |
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author | Mague, Joel T. Mohamed, Shaaban K. Akkurt, Mehmet Omran, Omran A. Albayati, Mustafa R. |
author_facet | Mague, Joel T. Mohamed, Shaaban K. Akkurt, Mehmet Omran, Omran A. Albayati, Mustafa R. |
author_sort | Mague, Joel T. |
collection | PubMed |
description | In the title compound, C(13)H(13)N(3)O, the phenyl ring makes a dihedral angle of 47.0 (1)° with the mean plane of the –NC(=O)N– unit, while the dihedral angle between the latter mean plane and the aminophenyl ring is 84.43 (7)°. In the crystal, molecules are linked via N—H⋯O hydrogen bonds involving the central –NHC(=O)NH– units, forming chains running parallel to the b axis. These chains associate with one another via N—H⋯O and N—H⋯N hydrogen bonds, from the pendant amino groups to the –NHC(=O)NH– units of adjacent molecules, forming columns propagating along [010]. The structure was refined as a two-component twin with a 0.933 (3):0.067 (3) domain ratio. |
format | Online Article Text |
id | pubmed-4384537 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-43845372015-04-15 Crystal structure of 1-(2-aminophenyl)-3-phenylurea Mague, Joel T. Mohamed, Shaaban K. Akkurt, Mehmet Omran, Omran A. Albayati, Mustafa R. Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(13)H(13)N(3)O, the phenyl ring makes a dihedral angle of 47.0 (1)° with the mean plane of the –NC(=O)N– unit, while the dihedral angle between the latter mean plane and the aminophenyl ring is 84.43 (7)°. In the crystal, molecules are linked via N—H⋯O hydrogen bonds involving the central –NHC(=O)NH– units, forming chains running parallel to the b axis. These chains associate with one another via N—H⋯O and N—H⋯N hydrogen bonds, from the pendant amino groups to the –NHC(=O)NH– units of adjacent molecules, forming columns propagating along [010]. The structure was refined as a two-component twin with a 0.933 (3):0.067 (3) domain ratio. International Union of Crystallography 2015-01-10 /pmc/articles/PMC4384537/ /pubmed/25878886 http://dx.doi.org/10.1107/S2056989014028175 Text en © Mague et al. 2015 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 | Data Reports Mague, Joel T. Mohamed, Shaaban K. Akkurt, Mehmet Omran, Omran A. Albayati, Mustafa R. Crystal structure of 1-(2-aminophenyl)-3-phenylurea |
title | Crystal structure of 1-(2-aminophenyl)-3-phenylurea |
title_full | Crystal structure of 1-(2-aminophenyl)-3-phenylurea |
title_fullStr | Crystal structure of 1-(2-aminophenyl)-3-phenylurea |
title_full_unstemmed | Crystal structure of 1-(2-aminophenyl)-3-phenylurea |
title_short | Crystal structure of 1-(2-aminophenyl)-3-phenylurea |
title_sort | crystal structure of 1-(2-aminophenyl)-3-phenylurea |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384537/ https://www.ncbi.nlm.nih.gov/pubmed/25878886 http://dx.doi.org/10.1107/S2056989014028175 |
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