1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde

The asymmetric unit of the title compound, C(17)H(10)FN(3)OS, consists of two crystallographically independent mol­ecules. In one mol­ecule, the pyrazole ring makes dihedral angles of 6.51 (7) and 34.02 (9)°, respectively, with the terminal 1,3-benzothia­zole ring system and the phenyl ring, while i...

Descripción completa

Detalles Bibliográficos
Autores principales: Fun, Hoong-Kun, Ooi, Chin Wei, Munirajasekhar, D., Himaja, M., Sarojini, B. K.
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/PMC3239088/
https://www.ncbi.nlm.nih.gov/pubmed/22199936
http://dx.doi.org/10.1107/S1600536811049634
_version_ 1782219121961730048
author Fun, Hoong-Kun
Ooi, Chin Wei
Munirajasekhar, D.
Himaja, M.
Sarojini, B. K.
author_facet Fun, Hoong-Kun
Ooi, Chin Wei
Munirajasekhar, D.
Himaja, M.
Sarojini, B. K.
author_sort Fun, Hoong-Kun
collection PubMed
description The asymmetric unit of the title compound, C(17)H(10)FN(3)OS, consists of two crystallographically independent mol­ecules. In one mol­ecule, the pyrazole ring makes dihedral angles of 6.51 (7) and 34.02 (9)°, respectively, with the terminal 1,3-benzothia­zole ring system and the phenyl ring, while in the other mol­ecule these values are 6.41 (8) and 23.06 (9)°. In the crystal, the molecules are linked by weak π–π [centroid–centroid distance = 3.7069 (10) Å] and C—H⋯π inter­actions.
format Online
Article
Text
id pubmed-3239088
institution National Center for Biotechnology Information
language English
publishDate 2011
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-32390882011-12-23 1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde Fun, Hoong-Kun Ooi, Chin Wei Munirajasekhar, D. Himaja, M. Sarojini, B. K. Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(17)H(10)FN(3)OS, consists of two crystallographically independent mol­ecules. In one mol­ecule, the pyrazole ring makes dihedral angles of 6.51 (7) and 34.02 (9)°, respectively, with the terminal 1,3-benzothia­zole ring system and the phenyl ring, while in the other mol­ecule these values are 6.41 (8) and 23.06 (9)°. In the crystal, the molecules are linked by weak π–π [centroid–centroid distance = 3.7069 (10) Å] and C—H⋯π inter­actions. International Union of Crystallography 2011-11-30 /pmc/articles/PMC3239088/ /pubmed/22199936 http://dx.doi.org/10.1107/S1600536811049634 Text en © Fun 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
Fun, Hoong-Kun
Ooi, Chin Wei
Munirajasekhar, D.
Himaja, M.
Sarojini, B. K.
1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde
title 1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde
title_full 1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde
title_fullStr 1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde
title_full_unstemmed 1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde
title_short 1-(6-Fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1H-pyrazole-4-carbaldehyde
title_sort 1-(6-fluoro-1,3-benzothia­zol-2-yl)-3-phenyl-1h-pyrazole-4-carbaldehyde
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239088/
https://www.ncbi.nlm.nih.gov/pubmed/22199936
http://dx.doi.org/10.1107/S1600536811049634
work_keys_str_mv AT funhoongkun 16fluoro13benzothiazol2yl3phenyl1hpyrazole4carbaldehyde
AT ooichinwei 16fluoro13benzothiazol2yl3phenyl1hpyrazole4carbaldehyde
AT munirajasekhard 16fluoro13benzothiazol2yl3phenyl1hpyrazole4carbaldehyde
AT himajam 16fluoro13benzothiazol2yl3phenyl1hpyrazole4carbaldehyde
AT sarojinibk 16fluoro13benzothiazol2yl3phenyl1hpyrazole4carbaldehyde

Ejemplares similares