Information card for entry 7155311

Structure parameters

• Chemical name: Butyl 5-(2-hydroxybenzoyl)-2-(phenylamino)nicotinate
• Formula: C23 H22 N2 O4
• Calculated formula: C23 H22 N2 O4
• Title of publication: A catalyst- and solvent-free thermal multicomponent approach for the construction of diverse and polysubstituted 2-aminopyridines and their antibacterial activity.
• Authors of publication: Baral, Ek Raj; Sharma, Kavita; Akhtar, Muhammad Saeed; Lee, Yong Rok
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2016
• Journal volume: 14
• Journal issue: 43
• Pages of publication: 10285 - 10297
• a: 12.1869 ± 0.0005 Å
• b: 14.43 ± 0.0006 Å
• c: 12.8949 ± 0.0005 Å
• α: 90°
• β: 115.941 ± 0.0017°
• γ: 90°
• Cell volume: 2039.18 ± 0.15 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0866
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No