Information card for entry 2218831

Structure parameters

• Chemical name: (<i>Z</i>)-3-Anilino-1,3-diphenylprop-2-en-1-one
• Formula: C21 H17 N O
• Calculated formula: C21 H17 N O
• SMILES: O=C(c1ccccc1)/C=C(\Nc1ccccc1)c1ccccc1
• Title of publication: (<i>Z</i>)-3-Anilino-1,3-diphenylprop-2-en-1-one
• Authors of publication: Zhang, Li-Ping; Wei, Lin-Juan; Chen, Ming-Qing; Zhang, Zhan-Hui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: o1327
• a: 15.88 ± 0.007 Å
• b: 6.034 ± 0.003 Å
• c: 18.401 ± 0.008 Å
• α: 90°
• β: 114.433 ± 0.007°
• γ: 90°
• Cell volume: 1605.3 ± 1.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 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: 0.136
• Residual factor for significantly intense reflections: 0.079
• Weighted residual factors for significantly intense reflections: 0.2115
• Weighted residual factors for all reflections included in the refinement: 0.2487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes