Information card for entry 2235218

Structure parameters

• Chemical name: 2-[4,5-Diphenyl-2-(pyridin-2-yl)-1<i>H</i>-imidazol-1-yl]-3-phenylpropan-1-ol
• Formula: C29 H25 N3 O
• Calculated formula: C29 H25 N3 O
• SMILES: OC[C@@H](n1c(c(nc1c1ncccc1)c1ccccc1)c1ccccc1)Cc1ccccc1
• Title of publication: 2-[4,5-Diphenyl-2-(pyridin-2-yl)-1<i>H</i>-imidazol-1-yl]-3-phenylpropan-1-ol
• Authors of publication: Yang, Liangru; Xiao, Yongmei; He, Kun; Yuan, Jinwei; Mao, Pu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: o1670
• a: 9.2695 ± 0.0004 Å
• b: 15.8818 ± 0.0006 Å
• c: 16.0498 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2362.79 ± 0.16 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 4
• 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: 0.044
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0962
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes