Information card for entry 8107070

Structure parameters

• Formula: C36 H28 N8
• Calculated formula: C35.5 H27.9 N8.4
• Title of publication: Crystal structure of 4,4′-di(1H-imidazol-1-yl)-1,1′-biphenyl, C36H28N8
• Authors of publication: Wu, Hai-Xia; Zheng, Min; Guo, Jin-Bo
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 3
• Pages of publication: 981 - 982
• a: 10.5381 ± 0.001 Å
• b: 11.2172 ± 0.0011 Å
• c: 14.0925 ± 0.0013 Å
• α: 73.912 ± 0.003°
• β: 68.626 ± 0.003°
• γ: 62.739 ± 0.003°
• Cell volume: 1366.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0947
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.1295
• Weighted residual factors for all reflections included in the refinement: 0.1429
• Goodness-of-fit parameter for all reflections included in the refinement: 1.162
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No