Information card for entry 2001462

Structure parameters

• Chemical name: α-phenyl-N-phenyl-N-(4-methoxyphenyl)-4'-amino-stilbene
• Formula: C33 H27 N O
• Calculated formula: C33 H27 N O
• SMILES: COc1ccc(cc1)N(c1ccccc1)c1ccc(cc1)C=C(c1ccccc1)c1ccccc1
• Title of publication: Structures of α-phenyl-amino-stilbene derivatives
• Authors of publication: Chiba, E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 8
• Pages of publication: 1511 - 1514
• a: 21.595 ± 0.005 Å
• b: 10.311 ± 0.003 Å
• c: 11.206 ± 0.001 Å
• α: 90°
• β: 97.44 ± 0.03°
• γ: 90°
• Cell volume: 2474.2 ± 1 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• 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: 0.053
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for all reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.047
• Goodness-of-fit parameter for all reflections: 1.19
• Goodness-of-fit parameter for significantly intense reflections: 1.19
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No