Information card for entry 4327444

Structure parameters

• Formula: C16 H30 N12 O12 P2 Zn2
• Calculated formula: C16 H30 N12 O12 P2 Zn2
• Title of publication: New Framework Connectivity Patterns in Templated Networks: The Creatinine Zinc Phosphites C4N3OH7.ZnHPO3, C4N3OH7.Zn(H2O)HPO3, and (C4N3OH7)2.ZnHPO3.H2O
• Authors of publication: William T. A. Harrison; Rachel M. Yeates; Mark L. F. Phillips; Tina M. Nenoff
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 1493 - 1498
• a: 10.7289 ± 0.0006 Å
• b: 10.9051 ± 0.0006 Å
• c: 13.9881 ± 0.0008 Å
• α: 89.508 ± 0.001°
• β: 74.995 ± 0.001°
• γ: 74.932 ± 0.001°
• Cell volume: 1523.42 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0803
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.0871
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 0.881
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No