Information card for entry 2225277

Structure parameters

• Chemical name: <i>N</i>-(2-Fluorophenyl)cinnamamide
• Formula: C15 H12 F N O
• Calculated formula: C15 H12 F N O
• SMILES: O=C(Nc1ccccc1F)/C=C/c1ccccc1
• Title of publication: <i>N</i>-(2-Fluorophenyl)cinnamamide
• Authors of publication: Saeed, Aamer; Khera, Rasheed Ahmad; Simpson, Jim
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: o533 - o534
• a: 9.6634 ± 0.0012 Å
• b: 13.0838 ± 0.0017 Å
• c: 19.404 ± 0.003 Å
• α: 90°
• β: 99.297 ± 0.007°
• γ: 90°
• Cell volume: 2421.1 ± 0.6 ų
• Cell temperature: 89 ± 2 K
• Ambient diffraction temperature: 89 ± 2 K
• Number of distinct elements: 5
• 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: 0.0713
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.1433
• Weighted residual factors for all reflections included in the refinement: 0.1556
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes