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N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide

In the title compound, C(24)H(20)FN(3)O(2), despite the 4H-pyran ring having a flattened half-chair conformation [the methine C atom lies 0.257 (3) Å above the plane of the remaining atoms with an r.m.s. deviation of 0.0295 Å], the 14 non-H atoms of the 4H-benzo[h]chromene residue are approximately...

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Autores principales: Al-dies, Al-anood M., Al-Omar, Mohamed A., Amr, Abd El-Galil E., El-Agrody, Ahmed M., Ng, Seik Weng, Tiekink, Edward R. T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3629518/
https://www.ncbi.nlm.nih.gov/pubmed/23634036
http://dx.doi.org/10.1107/S1600536813005503
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author Al-dies, Al-anood M.
Al-Omar, Mohamed A.
Amr, Abd El-Galil E.
El-Agrody, Ahmed M.
Ng, Seik Weng
Tiekink, Edward R. T.
author_facet Al-dies, Al-anood M.
Al-Omar, Mohamed A.
Amr, Abd El-Galil E.
El-Agrody, Ahmed M.
Ng, Seik Weng
Tiekink, Edward R. T.
author_sort Al-dies, Al-anood M.
collection PubMed
description In the title compound, C(24)H(20)FN(3)O(2), despite the 4H-pyran ring having a flattened half-chair conformation [the methine C atom lies 0.257 (3) Å above the plane of the remaining atoms with an r.m.s. deviation of 0.0295 Å], the 14 non-H atoms of the 4H-benzo[h]chromene residue are approximately coplanar (r.m.s. deviation = 0.081 Å). The benzene ring is nearly perpendicular to this plane [dihedral angle = 76.18 (10)°], but the planar (r.m.s. deviation = 0.033 Å) dimethyl­methanimidamide substituent is coplanar [dihedral angle = 1.96 (12)°]. In the crystal, centrosymmetric dimeric aggregates arise from C—H⋯N inter­actions, and these are connected into supra­molecular layers in the ab plane by C—H⋯π and π–π [inter­centroid (central C(6) ring)⋯(outer C(6) ring)(i) distance = 3.8564 (14) Å] inter­actions.
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spelling pubmed-36295182013-04-30 N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide Al-dies, Al-anood M. Al-Omar, Mohamed A. Amr, Abd El-Galil E. El-Agrody, Ahmed M. Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(24)H(20)FN(3)O(2), despite the 4H-pyran ring having a flattened half-chair conformation [the methine C atom lies 0.257 (3) Å above the plane of the remaining atoms with an r.m.s. deviation of 0.0295 Å], the 14 non-H atoms of the 4H-benzo[h]chromene residue are approximately coplanar (r.m.s. deviation = 0.081 Å). The benzene ring is nearly perpendicular to this plane [dihedral angle = 76.18 (10)°], but the planar (r.m.s. deviation = 0.033 Å) dimethyl­methanimidamide substituent is coplanar [dihedral angle = 1.96 (12)°]. In the crystal, centrosymmetric dimeric aggregates arise from C—H⋯N inter­actions, and these are connected into supra­molecular layers in the ab plane by C—H⋯π and π–π [inter­centroid (central C(6) ring)⋯(outer C(6) ring)(i) distance = 3.8564 (14) Å] inter­actions. International Union of Crystallography 2013-03-02 /pmc/articles/PMC3629518/ /pubmed/23634036 http://dx.doi.org/10.1107/S1600536813005503 Text en © Al-dies et al. 2013 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
Al-dies, Al-anood M.
Al-Omar, Mohamed A.
Amr, Abd El-Galil E.
El-Agrody, Ahmed M.
Ng, Seik Weng
Tiekink, Edward R. T.
N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide
title N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide
title_full N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide
title_fullStr N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide
title_full_unstemmed N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide
title_short N′-[3-Cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromen-2-yl]-N,N-dimethyl­methanimidamide
title_sort n′-[3-cyano-4-(4-fluoro­phen­yl)-6-meth­oxy-4h-benzo[h]chromen-2-yl]-n,n-dimethyl­methanimidamide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3629518/
https://www.ncbi.nlm.nih.gov/pubmed/23634036
http://dx.doi.org/10.1107/S1600536813005503
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