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5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one

In the mol­ecule of the title compound, C(15)H(13)FN(2)O, the phenyl and fluorophenyl rings are oriented at a dihedral angle of 77.92 (3)°. The pyrazolidine ring adopts an envelope conformation. An intra­molecular C—H⋯N hydrogen bond results in the formation of a five-membered ring adopting an envel...

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Detalles Bibliográficos
Autores principales: Liu, Yuan-Yuan, Shi, Hong, Chu, Qing-Yan, Zhu, Hong-Jun
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959324/
https://www.ncbi.nlm.nih.gov/pubmed/21201098
http://dx.doi.org/10.1107/S1600536808026706
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author Liu, Yuan-Yuan
Shi, Hong
Chu, Qing-Yan
Zhu, Hong-Jun
author_facet Liu, Yuan-Yuan
Shi, Hong
Chu, Qing-Yan
Zhu, Hong-Jun
author_sort Liu, Yuan-Yuan
collection PubMed
description In the mol­ecule of the title compound, C(15)H(13)FN(2)O, the phenyl and fluorophenyl rings are oriented at a dihedral angle of 77.92 (3)°. The pyrazolidine ring adopts an envelope conformation. An intra­molecular C—H⋯N hydrogen bond results in the formation of a five-membered ring adopting an envelope conformation. In the crystal structure, inter­molecular N—H⋯O and C—H⋯O hydrogen bonds link the mol­ecules. There are C—H⋯π contacts between between aromatic H atoms and the phenyl and fluorophenyl rings. A π–π contact between phenyl rings [centroid–centroid distance = 3.926 (1) Å] is also observed.
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spelling pubmed-29593242010-12-30 5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one Liu, Yuan-Yuan Shi, Hong Chu, Qing-Yan Zhu, Hong-Jun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the mol­ecule of the title compound, C(15)H(13)FN(2)O, the phenyl and fluorophenyl rings are oriented at a dihedral angle of 77.92 (3)°. The pyrazolidine ring adopts an envelope conformation. An intra­molecular C—H⋯N hydrogen bond results in the formation of a five-membered ring adopting an envelope conformation. In the crystal structure, inter­molecular N—H⋯O and C—H⋯O hydrogen bonds link the mol­ecules. There are C—H⋯π contacts between between aromatic H atoms and the phenyl and fluorophenyl rings. A π–π contact between phenyl rings [centroid–centroid distance = 3.926 (1) Å] is also observed. International Union of Crystallography 2008-09-06 /pmc/articles/PMC2959324/ /pubmed/21201098 http://dx.doi.org/10.1107/S1600536808026706 Text en © Liu et al. 2008 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
Liu, Yuan-Yuan
Shi, Hong
Chu, Qing-Yan
Zhu, Hong-Jun
5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one
title 5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one
title_full 5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one
title_fullStr 5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one
title_full_unstemmed 5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one
title_short 5-(3-Fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one
title_sort 5-(3-fluoro­phen­yl)-1-phenyl­pyrazolidin-3-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959324/
https://www.ncbi.nlm.nih.gov/pubmed/21201098
http://dx.doi.org/10.1107/S1600536808026706
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