Cargando…
Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate
In the molecule of the title compound, C(12)H(11)ClN(4)O(4), the pyrazole ring is coplanar with the amino and ethoxycarbonyl groups within 0.026 (2) and 0.105 (2) Å, respectively. The C (6) ring of the 4-chloro-2-nitrophenyl group is twisted by 53.58 (4)° relative to the plane of the pyrazole rin...
Autores principales: | , , , , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968147/ https://www.ncbi.nlm.nih.gov/pubmed/21581889 http://dx.doi.org/10.1107/S1600536809000488 |
_version_ | 1782189787935932416 |
---|---|
author | Zia-ur-Rehman, Muhammad Elsegood, Mark R. J. Choudary, Jamil Anwar Fasih Ullah, Muhammad Siddiqui, Hamid Latif |
author_facet | Zia-ur-Rehman, Muhammad Elsegood, Mark R. J. Choudary, Jamil Anwar Fasih Ullah, Muhammad Siddiqui, Hamid Latif |
author_sort | Zia-ur-Rehman, Muhammad |
collection | PubMed |
description | In the molecule of the title compound, C(12)H(11)ClN(4)O(4), the pyrazole ring is coplanar with the amino and ethoxycarbonyl groups within 0.026 (2) and 0.105 (2) Å, respectively. The C (6) ring of the 4-chloro-2-nitrophenyl group is twisted by 53.58 (4)° relative to the plane of the pyrazole ring. The planar structure of the pyrazole ring is stabilized by an intramolecular N—H⋯O hydrogen bond between its substituents. Neighbouring molecules are linked through intermolecular N—H⋯N and N—H⋯O hydrogen bonds, giving rise to one-dimensional tapes along the b axis. Molecules in the chain are linked to those of an adjacent chain through weak C—H⋯O interactions, forming a three-dimensional network. |
format | Text |
id | pubmed-2968147 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29681472010-12-30 Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate Zia-ur-Rehman, Muhammad Elsegood, Mark R. J. Choudary, Jamil Anwar Fasih Ullah, Muhammad Siddiqui, Hamid Latif Acta Crystallogr Sect E Struct Rep Online Organic Papers In the molecule of the title compound, C(12)H(11)ClN(4)O(4), the pyrazole ring is coplanar with the amino and ethoxycarbonyl groups within 0.026 (2) and 0.105 (2) Å, respectively. The C (6) ring of the 4-chloro-2-nitrophenyl group is twisted by 53.58 (4)° relative to the plane of the pyrazole ring. The planar structure of the pyrazole ring is stabilized by an intramolecular N—H⋯O hydrogen bond between its substituents. Neighbouring molecules are linked through intermolecular N—H⋯N and N—H⋯O hydrogen bonds, giving rise to one-dimensional tapes along the b axis. Molecules in the chain are linked to those of an adjacent chain through weak C—H⋯O interactions, forming a three-dimensional network. International Union of Crystallography 2009-01-10 /pmc/articles/PMC2968147/ /pubmed/21581889 http://dx.doi.org/10.1107/S1600536809000488 Text en © Zia-ur-Rehman et al. 2009 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 Zia-ur-Rehman, Muhammad Elsegood, Mark R. J. Choudary, Jamil Anwar Fasih Ullah, Muhammad Siddiqui, Hamid Latif Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate |
title | Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate |
title_full | Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate |
title_fullStr | Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate |
title_full_unstemmed | Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate |
title_short | Ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1H-pyrazole-4-carboxylate |
title_sort | ethyl 5-amino-1-(4-chloro-2-nitrophenyl)-1h-pyrazole-4-carboxylate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968147/ https://www.ncbi.nlm.nih.gov/pubmed/21581889 http://dx.doi.org/10.1107/S1600536809000488 |
work_keys_str_mv | AT ziaurrehmanmuhammad ethyl5amino14chloro2nitrophenyl1hpyrazole4carboxylate AT elsegoodmarkrj ethyl5amino14chloro2nitrophenyl1hpyrazole4carboxylate AT choudaryjamilanwar ethyl5amino14chloro2nitrophenyl1hpyrazole4carboxylate AT fasihullahmuhammad ethyl5amino14chloro2nitrophenyl1hpyrazole4carboxylate AT siddiquihamidlatif ethyl5amino14chloro2nitrophenyl1hpyrazole4carboxylate |