Information card for entry 2023319

Structure parameters

• Common name: <i>N</i>-(4-Methoxyphenyl)picolinamide
• Chemical name: <i>N</i>-(4-Methoxyphenyl)pyridine-2-carboxamide
• Formula: C13 H12 N2 O2
• Calculated formula: C13 H12 N2 O2
• SMILES: O=C(Nc1ccc(OC)cc1)c1ncccc1
• Title of publication: Synthesis, crystal structure and Hirshfeld surface analysis of N-(4-methoxyphenyl)picolinamide
• Authors of publication: Burieva, Dilnoza; Torambetov, Batirbay; Bobonazarova, Sarvinoz; Abdushukurov, Anvar; Kholikov, Tursinali; Khan, Akram A.; Ashurov, Jamshid; Yusufov, Mukhriddin
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 12
• a: 5.0082 ± 0.0009 Å
• b: 20.728 ± 0.004 Å
• c: 11.1549 ± 0.0014 Å
• α: 90°
• β: 96.998 ± 0.015°
• γ: 90°
• Cell volume: 1149.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1546
• Residual factor for significantly intense reflections: 0.0609
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.1391
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No