Information card for entry 7233787

Structure parameters

• Common name: 2-[(2,6-dimethylphenyl)amino]benzoic acid
• Chemical name: 2-[(2,6-dimethylphenyl)amino]benzoic acid
• Formula: C7.5 H7.5 N0.5 O
• Calculated formula: C7.5 H7.5 N0.5 O
• Title of publication: Comment on ‘Solution growth and thermal treatment of crystals lead to two new forms of 2-((2,6-dimethylphenyl)amino)benzoic acid’ by R. Hu, Y. Zhoujin, M. Liu, M. Zhang, S. Parkin, P. Zhou, J. Wang, F. Yu and S. Long, RSC Adv., 2018, 8, 15459
• Authors of publication: Salbego, Paulo R. S.; Orlando, Tainára; Martins, Marcos A. P.
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 48
• Pages of publication: 28195
• a: 7.5311 ± 0.0007 Å
• b: 8.096 ± 0.0009 Å
• c: 11.1845 ± 0.0012 Å
• α: 72.496 ± 0.01°
• β: 83.728 ± 0.009°
• γ: 73.792 ± 0.017°
• Cell volume: 624.28 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.037
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.1068
• Weighted residual factors for all reflections included in the refinement: 0.1071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No