Information card for entry 8106441

Structure parameters

• Chemical name: [Bis(Nitrate)(3-(4-pyridyl)pyrazole)(water)zinc(II)]
• Formula: C16 H18 Mn N8 O8
• Calculated formula: C16 H18 Mn N8 O8
• Title of publication: Crystal structure of diaqua-dinitrato-κO-bis(4-(1H-pyrazol-3-yl)pyridine-κN)manganese(II), C16H18MnN8O8
• Authors of publication: Zhu, Guang-Zhou; Li, Chun-Ling; Feng, Yu-Yu; Feng, Xiao-Wan; Yang, Feng-Lei
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 1
• Pages of publication: 87 - 88
• a: 7.3533 ± 0.0003 Å
• b: 11.8078 ± 0.0005 Å
• c: 12.6376 ± 0.0005 Å
• α: 90°
• β: 110.028 ± 0.002°
• γ: 90°
• Cell volume: 1030.92 ± 0.07 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0338
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No