Information card for entry 4513343

Structure parameters

• Common name: N-(2-methylphenyl)anthranilic acid
• Chemical name: N-(2-methylphenyl)anthranilic acid
• Formula: C14 H13 N O2
• Calculated formula: C14 H13 N O2
• SMILES: OC(=O)c1c(Nc2ccccc2C)cccc1
• Title of publication: Structure‒Polymorphism Study of Fenamates: Toward Developing an Understanding of the Polymorphophore
• Authors of publication: López-Mejías, Vilmalí; Matzger, Adam J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 8
• Pages of publication: 3955
• a: 7.1535 ± 0.0005 Å
• b: 25.0556 ± 0.0016 Å
• c: 7.3743 ± 0.001 Å
• α: 90°
• β: 118.367 ± 0.006°
• γ: 90°
• Cell volume: 1163 ± 0.2 ų
• Cell temperature: 95 ± 2 K
• Ambient diffraction temperature: 95 ± 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: 0.0782
• Residual factor for significantly intense reflections: 0.0636
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.164
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No