Cargando…
2-Allyl-7-nitro-2H-indazole
The asymmetric unit of the title compound, C(10)H(9)N(3)O(2), contains two independent molecules linked by a C—H⋯N hydrogen bond. Each molecule has a similar conformation, being built up from fused five- and six-membered rings, each linked to an ally and nitro group, respectively. The indazole rin...
Autores principales: | , , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884280/ https://www.ncbi.nlm.nih.gov/pubmed/24454056 http://dx.doi.org/10.1107/S1600536813026743 |
_version_ | 1782298554298007552 |
---|---|
author | Kouakou, Assoman Rakib, El Mostapha Spinelli, Domenico Saadi, Mohamed El Ammari, Lahcen |
author_facet | Kouakou, Assoman Rakib, El Mostapha Spinelli, Domenico Saadi, Mohamed El Ammari, Lahcen |
author_sort | Kouakou, Assoman |
collection | PubMed |
description | The asymmetric unit of the title compound, C(10)H(9)N(3)O(2), contains two independent molecules linked by a C—H⋯N hydrogen bond. Each molecule has a similar conformation, being built up from fused five- and six-membered rings, each linked to an ally and nitro group, respectively. The indazole ring system makes dihedral angles of 2.7 (2) and 2.2 (2)°, respectively, with the plane through the nitro group. The allyl group is nearly perpendicular to the indazole system, as indicated by the N—N—C—C torsion angles of −75.3 (2) and −82.2 (2)°, this being the most important difference between the conformations of the two molecules. In the crystal, molecules are linked by C—H⋯O and π–π [inter-centroid distance = 3.6225 (8) Å] interactions to form a three-dimensional network. |
format | Online Article Text |
id | pubmed-3884280 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-38842802014-01-17 2-Allyl-7-nitro-2H-indazole Kouakou, Assoman Rakib, El Mostapha Spinelli, Domenico Saadi, Mohamed El Ammari, Lahcen Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(10)H(9)N(3)O(2), contains two independent molecules linked by a C—H⋯N hydrogen bond. Each molecule has a similar conformation, being built up from fused five- and six-membered rings, each linked to an ally and nitro group, respectively. The indazole ring system makes dihedral angles of 2.7 (2) and 2.2 (2)°, respectively, with the plane through the nitro group. The allyl group is nearly perpendicular to the indazole system, as indicated by the N—N—C—C torsion angles of −75.3 (2) and −82.2 (2)°, this being the most important difference between the conformations of the two molecules. In the crystal, molecules are linked by C—H⋯O and π–π [inter-centroid distance = 3.6225 (8) Å] interactions to form a three-dimensional network. International Union of Crystallography 2013-10-02 /pmc/articles/PMC3884280/ /pubmed/24454056 http://dx.doi.org/10.1107/S1600536813026743 Text en © Kouakou 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 Kouakou, Assoman Rakib, El Mostapha Spinelli, Domenico Saadi, Mohamed El Ammari, Lahcen 2-Allyl-7-nitro-2H-indazole |
title | 2-Allyl-7-nitro-2H-indazole |
title_full | 2-Allyl-7-nitro-2H-indazole |
title_fullStr | 2-Allyl-7-nitro-2H-indazole |
title_full_unstemmed | 2-Allyl-7-nitro-2H-indazole |
title_short | 2-Allyl-7-nitro-2H-indazole |
title_sort | 2-allyl-7-nitro-2h-indazole |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884280/ https://www.ncbi.nlm.nih.gov/pubmed/24454056 http://dx.doi.org/10.1107/S1600536813026743 |
work_keys_str_mv | AT kouakouassoman 2allyl7nitro2hindazole AT rakibelmostapha 2allyl7nitro2hindazole AT spinellidomenico 2allyl7nitro2hindazole AT saadimohamed 2allyl7nitro2hindazole AT elammarilahcen 2allyl7nitro2hindazole |