Cargando…

2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile

In the title mol­ecule, C(21)H(15)FN(2)O(2), the dihedral angle between the fluoro-substituted benzene ring and the mean plane of the 4H-benzo[h]chromene ring system [maximum deviation = 0.109 (2) Å] is 83.35 (7)°. The pyran ring adopts a slight sofa conformation with the tertiary C(H) atom forming...

Descripción completa

Detalles Bibliográficos
Autores principales: Al-Dies, Al-Anood M., Amr, Abdel-Galil E., El-Agrody, Ahmed M., Chia, Tze Shyang, Fun, Hoong-Kun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379488/
https://www.ncbi.nlm.nih.gov/pubmed/22719686
http://dx.doi.org/10.1107/S1600536812023021
_version_ 1782236211766624256
author Al-Dies, Al-Anood M.
Amr, Abdel-Galil E.
El-Agrody, Ahmed M.
Chia, Tze Shyang
Fun, Hoong-Kun
author_facet Al-Dies, Al-Anood M.
Amr, Abdel-Galil E.
El-Agrody, Ahmed M.
Chia, Tze Shyang
Fun, Hoong-Kun
author_sort Al-Dies, Al-Anood M.
collection PubMed
description In the title mol­ecule, C(21)H(15)FN(2)O(2), the dihedral angle between the fluoro-substituted benzene ring and the mean plane of the 4H-benzo[h]chromene ring system [maximum deviation = 0.109 (2) Å] is 83.35 (7)°. The pyran ring adopts a slight sofa conformation with the tertiary C(H) atom forming the flap. The meth­oxy group is slightly twisted from the attached benzene ring of the 4H-benzo[h]chromene moiety [C—O—C—C = −4.3 (3)°]. In the crystal, mol­ecules are linked by inter­molecular N—H⋯N hydrogen bonds into infinite wave-like chains along the b axis. The crystal packing is further stabilized by π–π inter­actions [centroid–centroid distance = 3.7713 (9) Å].
format Online
Article
Text
id pubmed-3379488
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-33794882012-06-20 2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile Al-Dies, Al-Anood M. Amr, Abdel-Galil E. El-Agrody, Ahmed M. Chia, Tze Shyang Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title mol­ecule, C(21)H(15)FN(2)O(2), the dihedral angle between the fluoro-substituted benzene ring and the mean plane of the 4H-benzo[h]chromene ring system [maximum deviation = 0.109 (2) Å] is 83.35 (7)°. The pyran ring adopts a slight sofa conformation with the tertiary C(H) atom forming the flap. The meth­oxy group is slightly twisted from the attached benzene ring of the 4H-benzo[h]chromene moiety [C—O—C—C = −4.3 (3)°]. In the crystal, mol­ecules are linked by inter­molecular N—H⋯N hydrogen bonds into infinite wave-like chains along the b axis. The crystal packing is further stabilized by π–π inter­actions [centroid–centroid distance = 3.7713 (9) Å]. International Union of Crystallography 2012-05-31 /pmc/articles/PMC3379488/ /pubmed/22719686 http://dx.doi.org/10.1107/S1600536812023021 Text en © Al-Dies et al. 2012 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.
Amr, Abdel-Galil E.
El-Agrody, Ahmed M.
Chia, Tze Shyang
Fun, Hoong-Kun
2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile
title 2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile
title_full 2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile
title_fullStr 2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile
title_full_unstemmed 2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile
title_short 2-Amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4H-benzo[h]chromene-3-carbonitrile
title_sort 2-amino-4-(4-fluoro­phen­yl)-6-meth­oxy-4h-benzo[h]chromene-3-carbonitrile
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379488/
https://www.ncbi.nlm.nih.gov/pubmed/22719686
http://dx.doi.org/10.1107/S1600536812023021
work_keys_str_mv AT aldiesalanoodm 2amino44fluorophenyl6methoxy4hbenzohchromene3carbonitrile
AT amrabdelgalile 2amino44fluorophenyl6methoxy4hbenzohchromene3carbonitrile
AT elagrodyahmedm 2amino44fluorophenyl6methoxy4hbenzohchromene3carbonitrile
AT chiatzeshyang 2amino44fluorophenyl6methoxy4hbenzohchromene3carbonitrile
AT funhoongkun 2amino44fluorophenyl6methoxy4hbenzohchromene3carbonitrile