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1-Decyl-6-nitro-1H-benzimidazol-2(3H)-one.

ABSTRACT: The title mol-ecule, C(17)H(25)N(3)O(3), is built up from fused six- and five-membered rings linked to a -C(10)H(21) chain. The fused-ring system is essentially planar, the largest deviation from the mean plane being 0.009?(2)?Å. The chain is roughly perpendic-ular to this plane, making a dihedral angle of 79.5?(2)°. In the crystal, N-H?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 ?). Acta Cryst. D65, 148-155].

SUBMITTER: Ouzidan Y 

PROVIDER: S-EPMC3247349 | biostudies-literature | 2011 Nov

REPOSITORIES: biostudies-literature

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1-Decyl-6-nitro-1H-benzimidazol-2(3H)-one.

Ouzidan Younes Y   Kandri Rodi Youssef Y   Essassi El Mokhtar el M   Luis Santiago V SV   Bolte Michael M   El Ammari Lahcen L  

Acta crystallographica. Section E, Structure reports online 20111012 Pt 11

The title mol-ecule, C(17)H(25)N(3)O(3), is built up from fused six- and five-membered rings linked to a -C(10)H(21) chain. The fused-ring system is essentially planar, the largest deviation from the mean plane being 0.009 (2) Å. The chain is roughly perpendic-ular to this plane, making a dihedral angle of 79.5 (2)°. In the crystal, N-H⋯O hydrogen bonds build infinite chains along [010]. There are channels in the structure containing disordered hexane. The contribution of this solvent to the sca  ...[more]

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