Information card for entry 2217053

Structure parameters

• Chemical name: 4,4'-Bis(benzimidazol-1-yl)biphenyl
• Formula: C26 H18 N4
• Calculated formula: C26 H18 N4
• SMILES: c1ccc2c(c1)n(cn2)c1ccc(cc1)c1ccc(cc1)n1cnc2c1cccc2
• Title of publication: 4,4'-Bis(benzimidazol-1-yl)biphenyl
• Authors of publication: Li, Zuo-Xi; Zuo, Yi; Hu, Tong-Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o141 - o141
• a: 19.628 ± 0.004 Å
• b: 6.8964 ± 0.0014 Å
• c: 13.76 ± 0.003 Å
• α: 90°
• β: 90.74 ± 0.03°
• γ: 90°
• Cell volume: 1862.4 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0993
• Weighted residual factors for all reflections included in the refinement: 0.1032
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes