Information card for entry 2233423

Structure parameters

• Chemical name: 1,2,4,5-Tetraphenyl-1<i>H</i>-imidazole
• Formula: C27 H20 N2
• Calculated formula: C27 H20 N2
• SMILES: c1ccc(cc1)c1nc(c(n1c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: 1,2,4,5-Tetraphenyl-1<i>H</i>-imidazole
• Authors of publication: Zhao, Bing; Li, Zhi-yu; Fan, Meng-jiao; Song, Bo; Deng, Qi-gang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 2
• Pages of publication: o542
• a: 9.8169 ± 0.0015 Å
• b: 9.8846 ± 0.0015 Å
• c: 20.601 ± 0.003 Å
• α: 81.133 ± 0.005°
• β: 82.922 ± 0.006°
• γ: 84.085 ± 0.006°
• Cell volume: 1952.9 ± 0.5 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0503
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0851
• Weighted residual factors for all reflections included in the refinement: 0.0901
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes