Information card for entry 2244149

Structure parameters

• Chemical name: 4-(3-Methoxyphenyl)-2,6-diphenylpyridine
• Formula: C24 H19 N O
• Calculated formula: C24 H19 N O
• SMILES: O(c1cccc(c2cc(nc(c2)c2ccccc2)c2ccccc2)c1)C
• Title of publication: Crystal structure and Hirshfeld surface analysis of 4-(3-methoxyphenyl)-2,6-diphenylpyridine
• Authors of publication: Cheng, Dong; Meng, Xiang-Zhen; Tian, Fuyu; Yan, Dong; Wang, Xiaofei; Qian, Xueli; Wang, Junnan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2022
• Journal volume: 78
• Journal issue: 9
• a: 18.6588 ± 0.0002 Å
• b: 5.4739 ± 0.0001 Å
• c: 35.5689 ± 0.0005 Å
• α: 90°
• β: 100.729 ± 0.001°
• γ: 90°
• Cell volume: 3569.37 ± 0.09 ų
• Cell temperature: 200 ± 0.1 K
• Ambient diffraction temperature: 200 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0363
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0971
• Weighted residual factors for all reflections included in the refinement: 0.0988
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes