Information card for entry 8107583

Structure parameters

• Formula: C18 H27 N5 O6
• Calculated formula: C18 H27 N5 O6
• Title of publication: Crystal structure of (E)-2-amino-N′-((3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl)methylene)benzohydrazide – dimethylformamide – water (1/1/2), C15H16N4O3·C3H7NO·2H2O
• Authors of publication: Wang, Xue; Han, Jie; Zheng, Jing; Yuan, Xiao-Jing; Xiong, Ying
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 5
• Pages of publication: 861 - 862
• a: 11.6588 ± 0.0012 Å
• b: 7.0645 ± 0.0006 Å
• c: 25.7 ± 0.003 Å
• α: 90°
• β: 94.899 ± 0.003°
• γ: 90°
• Cell volume: 2109 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 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: 0.1749
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.1341
• Weighted residual factors for all reflections included in the refinement: 0.1632
• Goodness-of-fit parameter for all reflections included in the refinement: 0.917
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No