Information card for entry 8106307

Structure parameters

• Formula: C11 H10 N4 O2
• Calculated formula: C11 H10 N4 O2
• Title of publication: Crystal structure of 2-hydroxy-N′-(pyrimidin-2-yl)benzohydrazide, C11H10N4O2
• Authors of publication: Yuan, Juan; Xing, Ai-Ping; Cheng, Di
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 5
• Pages of publication: 817 - 818
• a: 6.6161 ± 0.0007 Å
• b: 24.064 ± 0.002 Å
• c: 7.1768 ± 0.0009 Å
• α: 90°
• β: 115.463 ± 0.015°
• γ: 90°
• Cell volume: 1031.6 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 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: 0.0554
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0886
• Weighted residual factors for all reflections included in the refinement: 0.0953
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No