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3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide
In the title compound, C(14)H(15)N(3)O(2), the phenylene ring is disordered over two orientations. As a result, the almost planar pyrazole ring (r.m.s. deviation = 0.004 Å) forms dihedral angles of 59.8 (1) and −61.9 (1)° with the two orientations of the phenylene ring. The dihedral angle between...
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/PMC3009041/ https://www.ncbi.nlm.nih.gov/pubmed/21589170 http://dx.doi.org/10.1107/S1600536810043928 |
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author | Abdel-Aziz, Hatem A. Bari, Ahmed Ng, Seik Weng |
author_facet | Abdel-Aziz, Hatem A. Bari, Ahmed Ng, Seik Weng |
author_sort | Abdel-Aziz, Hatem A. |
collection | PubMed |
description | In the title compound, C(14)H(15)N(3)O(2), the phenylene ring is disordered over two orientations. As a result, the almost planar pyrazole ring (r.m.s. deviation = 0.004 Å) forms dihedral angles of 59.8 (1) and −61.9 (1)° with the two orientations of the phenylene ring. The dihedral angle between the two orientations is 59.2 (1)°. In the crystal, inversion dimers lined by pairs of N—H⋯O hydrogen bonds occur; there is also an intramolecular N—H⋯O bond. |
format | Text |
id | pubmed-3009041 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30090412010-12-30 3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide Abdel-Aziz, Hatem A. Bari, Ahmed Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(14)H(15)N(3)O(2), the phenylene ring is disordered over two orientations. As a result, the almost planar pyrazole ring (r.m.s. deviation = 0.004 Å) forms dihedral angles of 59.8 (1) and −61.9 (1)° with the two orientations of the phenylene ring. The dihedral angle between the two orientations is 59.2 (1)°. In the crystal, inversion dimers lined by pairs of N—H⋯O hydrogen bonds occur; there is also an intramolecular N—H⋯O bond. International Union of Crystallography 2010-10-31 /pmc/articles/PMC3009041/ /pubmed/21589170 http://dx.doi.org/10.1107/S1600536810043928 Text en © Abdel-Aziz 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 Abdel-Aziz, Hatem A. Bari, Ahmed Ng, Seik Weng 3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide |
title | 3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide |
title_full | 3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide |
title_fullStr | 3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide |
title_full_unstemmed | 3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide |
title_short | 3-Acetyl-5-methyl-1-(4-methylphenyl)-1H-pyrazole-4-carboxamide |
title_sort | 3-acetyl-5-methyl-1-(4-methylphenyl)-1h-pyrazole-4-carboxamide |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3009041/ https://www.ncbi.nlm.nih.gov/pubmed/21589170 http://dx.doi.org/10.1107/S1600536810043928 |
work_keys_str_mv | AT abdelazizhatema 3acetyl5methyl14methylphenyl1hpyrazole4carboxamide AT bariahmed 3acetyl5methyl14methylphenyl1hpyrazole4carboxamide AT ngseikweng 3acetyl5methyl14methylphenyl1hpyrazole4carboxamide |