Information card for entry 4504128

Structure parameters

• Formula: C4 H13 N O6 P2 Zn
• Calculated formula: C4 H13 N O6 P2 Zn
• Title of publication: Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks
• Authors of publication: Fu, Ruibiao; Hu, Shengmin; Wu, Xintao
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 6
• Pages of publication: 1134
• a: 4.8852 ± 0.0018 Å
• b: 9.986 ± 0.004 Å
• c: 10.432 ± 0.004 Å
• α: 92.918 ± 0.004°
• β: 98.418 ± 0.006°
• γ: 90.801 ± 0.006°
• Cell volume: 502.7 ± 0.3 ų
• Cell temperature: 130.15 K
• Ambient diffraction temperature: 130.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0244
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.0556
• Weighted residual factors for all reflections included in the refinement: 0.0575
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No