Information card for entry 2226881

Structure parameters

• Chemical name: <i>N</i>-(4-Methylphenyl)-6-(pyrazol-1-yl)pyridazin-3-amine
• Formula: C14 H13 N5
• Calculated formula: C14 H13 N5
• Title of publication: <i>N</i>-(4-Methylphenyl)-6-(pyrazol-1-yl)pyridazin-3-amine
• Authors of publication: Ather, Abdul Qayyum; Tahir, M. Nawaz; Khan, Misbahul Ain; Athar, Muhammad Makshoof; Bueno, Eliana Aparecida Silicz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: o1900
• a: 31.8677 ± 0.0017 Å
• b: 7.9408 ± 0.0005 Å
• c: 10.8446 ± 0.0007 Å
• α: 90°
• β: 109.715 ± 0.003°
• γ: 90°
• Cell volume: 2583.4 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1082
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1467
• Weighted residual factors for all reflections included in the refinement: 0.1756
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes