Information card for entry 8105083

Structure parameters

• Formula: C12 H12 N8 O7 Zn
• Calculated formula: C12 H12 N8 O7 Zn
• Title of publication: Crystal structure of N-(amino(pyrazin-2-yl)methylene)-6-methylpyridin-1-ium-3-carbohydrazonate-κ3 O,N,N′)-(dinitrato-κ1O)zinc(II), C12H12N8O7Zn
• Authors of publication: Yan, Jin-Long
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 2
• Pages of publication: 283 - 284
• a: 8.2116 ± 0.0003 Å
• b: 11.1926 ± 0.0004 Å
• c: 17.3488 ± 0.0007 Å
• α: 90°
• β: 96.245 ± 0.001°
• γ: 90°
• Cell volume: 1585.05 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0274
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0713
• Weighted residual factors for all reflections included in the refinement: 0.0722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No