Information card for entry 2221492

Structure parameters

• Chemical name: 2-Fluoro-<i>N</i>-(4-methoxyphenyl)benzamide
• Formula: C14 H12 F N O2
• Calculated formula: C14 H12 F N O2
• SMILES: N(C(=O)c1c(F)cccc1)c1ccc(cc1)OC
• Title of publication: 2-Fluoro-<i>N</i>-(4-methoxyphenyl)benzamide
• Authors of publication: Saeed, Aamer; Khera, Rasheed Ahmad; Arfan, Madiah; Simpson, Jim; Stanley, Roderick G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o802 - o803
• a: 5.2901 ± 0.0002 Å
• b: 6.6435 ± 0.0003 Å
• c: 31.7823 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1116.98 ± 0.08 ų
• Cell temperature: 89 ± 2 K
• Ambient diffraction temperature: 89 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0924
• Weighted residual factors for all reflections included in the refinement: 0.0956
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes