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Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione

In the title compound, C(22)H(18)N(2)O(4), the three fused rings of the pyrazolo­phthalazine moiety are coplanar (r.m.s. deviation = 0.027 Å). The cyclo­hexene ring fused to the pyrazolidine ring, so forming the indazolophthalazine unit, has a half-chair conformation. The benzene ring is almost norm...

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Autores principales: Bouraiou, Abdelmalek, Bouacida, Sofiane, Merazig, Hocine, Chibani, Aissa, Bouaziz, Zouhair
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571420/
https://www.ncbi.nlm.nih.gov/pubmed/26396820
http://dx.doi.org/10.1107/S2056989015013894
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author Bouraiou, Abdelmalek
Bouacida, Sofiane
Merazig, Hocine
Chibani, Aissa
Bouaziz, Zouhair
author_facet Bouraiou, Abdelmalek
Bouacida, Sofiane
Merazig, Hocine
Chibani, Aissa
Bouaziz, Zouhair
author_sort Bouraiou, Abdelmalek
collection PubMed
description In the title compound, C(22)H(18)N(2)O(4), the three fused rings of the pyrazolo­phthalazine moiety are coplanar (r.m.s. deviation = 0.027 Å). The cyclo­hexene ring fused to the pyrazolidine ring, so forming the indazolophthalazine unit, has a half-chair conformation. The benzene ring is almost normal to the mean plane of the pyrazolo­phthalazine moiety, with a dihedral angle of 87.21 (6)° between their planes. In the crystal, mol­ecules are linked by pairs of C—H⋯O hydrogen bonds forming inversion dimers. The dimers are linked via C—H⋯π inter­actions, forming slabs parallel to (100). Between the slabs there are weak π–π inter­actions [shortest inter-centroid distance = 3.6664 (9) Å], leading to the formation of a three-dimensional structure.
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spelling pubmed-45714202015-09-22 Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione Bouraiou, Abdelmalek Bouacida, Sofiane Merazig, Hocine Chibani, Aissa Bouaziz, Zouhair Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(22)H(18)N(2)O(4), the three fused rings of the pyrazolo­phthalazine moiety are coplanar (r.m.s. deviation = 0.027 Å). The cyclo­hexene ring fused to the pyrazolidine ring, so forming the indazolophthalazine unit, has a half-chair conformation. The benzene ring is almost normal to the mean plane of the pyrazolo­phthalazine moiety, with a dihedral angle of 87.21 (6)° between their planes. In the crystal, mol­ecules are linked by pairs of C—H⋯O hydrogen bonds forming inversion dimers. The dimers are linked via C—H⋯π inter­actions, forming slabs parallel to (100). Between the slabs there are weak π–π inter­actions [shortest inter-centroid distance = 3.6664 (9) Å], leading to the formation of a three-dimensional structure. International Union of Crystallography 2015-07-25 /pmc/articles/PMC4571420/ /pubmed/26396820 http://dx.doi.org/10.1107/S2056989015013894 Text en © Bouraiou et al. 2015 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 Data Reports
Bouraiou, Abdelmalek
Bouacida, Sofiane
Merazig, Hocine
Chibani, Aissa
Bouaziz, Zouhair
Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione
title Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione
title_full Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione
title_fullStr Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione
title_full_unstemmed Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione
title_short Crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2H-indazolo[1,2-b]phthalazine-1,6,11(13H)-trione
title_sort crystal structure of 13-(2-meth­oxy­phenyl)-3,4-di­hydro-2h-indazolo[1,2-b]phthalazine-1,6,11(13h)-trione
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571420/
https://www.ncbi.nlm.nih.gov/pubmed/26396820
http://dx.doi.org/10.1107/S2056989015013894
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