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4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile

In the mol­ecule of the title compound, C(20)H(13)FN(2)O, the fluoro­phenyl ring is oriented at a dihedral angle of 72.76 (3)° with respect to the fused benzene ring. In the crystal structure, inter­molecular N—H⋯O, C—H⋯O and C—H⋯F inter­actions link the mol­ecules into chains. π–π contacts between...

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Detalles Bibliográficos
Autores principales: Zhang, Jinpeng, Ding, Jie, Yan, Shu, Rong, Liangce, Xu, Lichun
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969758/
https://www.ncbi.nlm.nih.gov/pubmed/21583205
http://dx.doi.org/10.1107/S1600536809017991
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author Zhang, Jinpeng
Ding, Jie
Yan, Shu
Rong, Liangce
Xu, Lichun
author_facet Zhang, Jinpeng
Ding, Jie
Yan, Shu
Rong, Liangce
Xu, Lichun
author_sort Zhang, Jinpeng
collection PubMed
description In the mol­ecule of the title compound, C(20)H(13)FN(2)O, the fluoro­phenyl ring is oriented at a dihedral angle of 72.76 (3)° with respect to the fused benzene ring. In the crystal structure, inter­molecular N—H⋯O, C—H⋯O and C—H⋯F inter­actions link the mol­ecules into chains. π–π contacts between the quinoline and benzene rings [centroid–centroid distance = 3.918 (3) Å] may further stabilize the structure. A weak C—H⋯π inter­action is also present. The O atom and two of the CH(2) groups of the quinoline ring system are disordered over two positions. The O atom was refined with occupancies of 0.489 (17) and 0.511 (17), while C and H atoms were refined with occupancies of 0.435 (13) and 0.565 (13).
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spelling pubmed-29697582010-12-30 4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile Zhang, Jinpeng Ding, Jie Yan, Shu Rong, Liangce Xu, Lichun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the mol­ecule of the title compound, C(20)H(13)FN(2)O, the fluoro­phenyl ring is oriented at a dihedral angle of 72.76 (3)° with respect to the fused benzene ring. In the crystal structure, inter­molecular N—H⋯O, C—H⋯O and C—H⋯F inter­actions link the mol­ecules into chains. π–π contacts between the quinoline and benzene rings [centroid–centroid distance = 3.918 (3) Å] may further stabilize the structure. A weak C—H⋯π inter­action is also present. The O atom and two of the CH(2) groups of the quinoline ring system are disordered over two positions. The O atom was refined with occupancies of 0.489 (17) and 0.511 (17), while C and H atoms were refined with occupancies of 0.435 (13) and 0.565 (13). International Union of Crystallography 2009-05-20 /pmc/articles/PMC2969758/ /pubmed/21583205 http://dx.doi.org/10.1107/S1600536809017991 Text en © Zhang 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
Zhang, Jinpeng
Ding, Jie
Yan, Shu
Rong, Liangce
Xu, Lichun
4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile
title 4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile
title_full 4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile
title_fullStr 4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile
title_full_unstemmed 4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile
title_short 4-(4-Fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile
title_sort 4-(4-fluoro­phen­yl)-2-oxo-1,2,5,6-tetra­hydro­benzo[h]quinoline-3-carbonitrile
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969758/
https://www.ncbi.nlm.nih.gov/pubmed/21583205
http://dx.doi.org/10.1107/S1600536809017991
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