Information card for entry 2211809

Structure parameters

• Chemical name: 2-[4-(Dimethylamino)phenyl]-1-{[4-(Dimethylamino)phenyl]methyl}- 1H-benzimidazole
• Formula: C24 H26 N4
• Calculated formula: C24 H26 N4
• SMILES: n1(c(nc2c1cccc2)c1ccc(N(C)C)cc1)Cc1ccc(N(C)C)cc1
• Title of publication: 2-[4-(Dimethylamino)phenyl]-1-{[4-(dimethylamino)phenyl]methyl}-1<i>H</i>-benzimidazole
• Authors of publication: Yang, Shu-Ping; Han, Li-Jun; Wang, Da-Qi; Ding, Tie-Zhu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 1
• Pages of publication: o365 - o367
• a: 18.754 ± 0.003 Å
• b: 6.294 ± 0.002 Å
• c: 18.522 ± 0.003 Å
• α: 90°
• β: 111.973 ± 0.003°
• γ: 90°
• Cell volume: 2027.5 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.123
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.065
• Weighted residual factors for all reflections included in the refinement: 0.073
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes