Information card for entry 2203878

Structure parameters

• Common name: diphenylimidazole
• Chemical name: 4,5-diphenyl-1H-imidazole
• Formula: C15 H12 N2
• Calculated formula: C15 H12 N2
• SMILES: [nH]1cnc(c1c1ccccc1)c1ccccc1
• Title of publication: A second polymorph of 4,5-diphenyl-1<i>H</i>-imidazole
• Authors of publication: Robert T. Stibrany; Harvey J. Schugar; Joseph A. Potenza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 7
• Pages of publication: o1182 - o1184
• a: 13.3716 ± 0.0007 Å
• b: 13.0984 ± 0.0008 Å
• c: 14.6909 ± 0.0012 Å
• α: 90°
• β: 110.343 ± 0.004°
• γ: 90°
• Cell volume: 2412.6 ± 0.3 ų
• Cell temperature: 296 ± 1 K
• Ambient diffraction temperature: 296 ± 1 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.08
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.172
• Weighted residual factors for all reflections included in the refinement: 0.1847
• 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