1-Decyl-6-nitro-1H-benzimidazol-2(3H)-on

The title mol­ecule, C17H25N3O3, is built up from fused six- and five-membered rings linked to a –C10H21 chain. The fused-ring system is essentially planar, the largest deviation from the mean plane being 0.009 (2) Å. Th
The title mol­ecule, C17H25N3O3, is built up from fused six- and five-membered rings linked to a –C10H21 chain. The fused-ring system is essentially planar, the largest deviation from the mean plane being 0.009 (2) Å. The chain is roughly perpendic­ular to this plane, making a dihedral angle of 79.5 (2)°. In the crystal, N—H[cdots, three dots, centered]O hydrogen bonds build infinite chains along [010]. There are channels in the structure containing disordered hexane. The contribution of this solvent to the scattering power was suppressed using the SQUEEZE option in PLATON [Spek (2009 [triangle]). Acta Cryst. D65, 148–155].
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Metadaten
Author:Younes Ouzidan, Youssef Kandri Rodi, El Mokhtar Essassi, Santiago V. Luis, Michael Bolte, Lahcen El Ammari
URN:urn:nbn:de:hebis:30:3-252822
DOI:http://dx.doi.org/10.1107/S1600536811041389
ISSN:1600-5368
Pubmed Id:http://www.ncbi.nlm.nih.gov/pubmed?term=22219967
Parent Title (English):Acta crystallographica : Section E, Structure reports online
Publisher:Munksgaard
Place of publication:Copenhagen
Document Type:Article
Language:English
Date of Publication (online):2012/10/12
Date of first Publication:2012/10/12
Publishing Institution:Univ.-Bibliothek Frankfurt am Main
Release Date:2012/06/25
Volume:67
Issue:o2937
Institutes:Biochemie und Chemie
Dewey Decimal Classification:540 Chemie und zugeordnete Wissenschaften
Sammlungen:Universitätspublikationen
Licence (German):License LogoCreative Commons - Namensnennung 3.0

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