Information card for entry 2231233

Structure parameters

• Chemical name: 1,4-Bis[(2-ethyl-1<i>H</i>-benzimidazol-1-yl)methyl]benzene
• Formula: C26 H26 N4
• Calculated formula: C26 H26 N4
• SMILES: CCc1nc2ccccc2n1Cc1ccc(Cn2c3ccccc3nc2CC)cc1
• Title of publication: 1,4-Bis[(2-ethyl-1<i>H</i>-benzimidazol-1-yl)methyl]benzene
• Authors of publication: Wang, Qiang; Zhao, Xing; Lou, Haipeng; Wang, Mengyan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o1899
• a: 10.3 ± 0.002 Å
• b: 11.437 ± 0.002 Å
• c: 17.809 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2097.9 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0892
• Residual factor for significantly intense reflections: 0.0758
• Weighted residual factors for significantly intense reflections: 0.1451
• Weighted residual factors for all reflections included in the refinement: 0.1531
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes