Information card for entry 4309638

Structure parameters

• Formula: C9 H9 N2 O4 P Zn
• Calculated formula: C9 H9 N2 O4 P Zn
• Title of publication: Novel Zinc Phosphate Topologies Defined by Organic Ligands
• Authors of publication: Jian Fan; Brian E. Hanson
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 6998 - 7008
• a: 8.762 ± 0.0007 Å
• b: 28.368 ± 0.003 Å
• c: 8.7638 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2178.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0662
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1117
• Weighted residual factors for all reflections included in the refinement: 0.1146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.287
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No