Ethyl 4-chloro-3,5-dinitro­benzoate

In the title compound, C(9)H(7)ClN(2)O(6), the nitro groups and the ester group make dihedral angles of 44.0 (1), 89.6 (1) and 164.1 (1)°, respectively, with the benzene ring. In the crystal, mol­ecules are linked through weak C—H⋯O hydrogen-bonding inter­actions. Mol­ecules are stacked via π–π inte...

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Detalles Bibliográficos
Autores principales: Wu, Hao, Xie, Min-Hao, Liu, Ya-Ling, He, Yong-Jun, Zou, Pei
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247331/
https://www.ncbi.nlm.nih.gov/pubmed/22219949
http://dx.doi.org/10.1107/S160053681103978X
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author Wu, Hao
Xie, Min-Hao
Liu, Ya-Ling
He, Yong-Jun
Zou, Pei
author_facet Wu, Hao
Xie, Min-Hao
Liu, Ya-Ling
He, Yong-Jun
Zou, Pei
author_sort Wu, Hao
collection PubMed
description In the title compound, C(9)H(7)ClN(2)O(6), the nitro groups and the ester group make dihedral angles of 44.0 (1), 89.6 (1) and 164.1 (1)°, respectively, with the benzene ring. In the crystal, mol­ecules are linked through weak C—H⋯O hydrogen-bonding inter­actions. Mol­ecules are stacked via π–π inter­actions about inversion centers, with a centroid–centroid distance of 3.671 (2) Å.
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spelling pubmed-32473312012-01-04 Ethyl 4-chloro-3,5-dinitro­benzoate Wu, Hao Xie, Min-Hao Liu, Ya-Ling He, Yong-Jun Zou, Pei Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(9)H(7)ClN(2)O(6), the nitro groups and the ester group make dihedral angles of 44.0 (1), 89.6 (1) and 164.1 (1)°, respectively, with the benzene ring. In the crystal, mol­ecules are linked through weak C—H⋯O hydrogen-bonding inter­actions. Mol­ecules are stacked via π–π inter­actions about inversion centers, with a centroid–centroid distance of 3.671 (2) Å. International Union of Crystallography 2011-10-12 /pmc/articles/PMC3247331/ /pubmed/22219949 http://dx.doi.org/10.1107/S160053681103978X Text en © Wu et al. 2011 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
Wu, Hao
Xie, Min-Hao
Liu, Ya-Ling
He, Yong-Jun
Zou, Pei
Ethyl 4-chloro-3,5-dinitro­benzoate
title Ethyl 4-chloro-3,5-dinitro­benzoate
title_full Ethyl 4-chloro-3,5-dinitro­benzoate
title_fullStr Ethyl 4-chloro-3,5-dinitro­benzoate
title_full_unstemmed Ethyl 4-chloro-3,5-dinitro­benzoate
title_short Ethyl 4-chloro-3,5-dinitro­benzoate
title_sort ethyl 4-chloro-3,5-dinitro­benzoate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247331/
https://www.ncbi.nlm.nih.gov/pubmed/22219949
http://dx.doi.org/10.1107/S160053681103978X
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AT liuyaling ethyl4chloro35dinitrobenzoate
AT heyongjun ethyl4chloro35dinitrobenzoate
AT zoupei ethyl4chloro35dinitrobenzoate

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