Information card for entry 2004472

Structure parameters

• Formula: C14 H10 F N O3
• Calculated formula: C14 H10 F N O3
• SMILES: Fc1ccccc1C(=O)Nc1ccccc1C(=O)O
• Title of publication: 2-(2-Fluorobenzoylamino)benzoic Acid
• Authors of publication: Ojala, W. H.; Clemons, J. E.; Ojala, C. R.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 2
• Pages of publication: 484 - 485
• a: 13.59 ± 0.002 Å
• b: 5.003 ± 0.002 Å
• c: 17.627 ± 0.002 Å
• α: 90°
• β: 108.26 ± 0.01°
• γ: 90°
• Cell volume: 1138.1 ± 0.5 ų
• Cell temperature: 173 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.037
• Goodness-of-fit parameter for significantly intense reflections: 2.12
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No