Information card for entry 8101819

Structure parameters

• Chemical name: 4-(4-(1H-imidazol-1-yl)phenyl)-2,6-diphenylpyridine
• Formula: C26 H19 N3
• Calculated formula: C26 H19 N3
• SMILES: c1cn(cn1)c1ccc(cc1)c1cc(c2ccccc2)nc(c1)c1ccccc1
• Title of publication: Crystal structure of 4-(4-(1H-imidazol-1-yl)phenyl)-2,6-diphenylpyridine, C~26~H~19~N~3~
• Authors of publication: Y.-Z. Wu; C.-X. Wang; W.-T. Yu; J.-X. Yang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2005
• Journal volume: 220
• Journal issue: 3
• Pages of publication: 443 - 444
• a: 12.8849 ± 0.0014 Å
• b: 15.007 ± 0.002 Å
• c: 10.8625 ± 0.0015 Å
• α: 90°
• β: 109.46 ± 0.008°
• γ: 90°
• Cell volume: 1980.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2269
• Residual factor for significantly intense reflections: 0.0603
• Weighted residual factors for significantly intense reflections: 0.1197
• Weighted residual factors for all reflections included in the refinement: 0.1844
• Goodness-of-fit parameter for all reflections included in the refinement: 0.857
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No