Information card for entry 4309636

Structure parameters

• Formula: C27 H33 N6 O10 P2 Zn2
• Calculated formula: C27 H29 N6 O10 P2 Zn2
• 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: 9.0382 ± 0.0009 Å
• b: 13.6616 ± 0.001 Å
• c: 13.7094 ± 0.0009 Å
• α: 99.997 ± 0.006°
• β: 101.158 ± 0.007°
• γ: 108.14 ± 0.008°
• Cell volume: 1527.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0525
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1263
• Weighted residual factors for all reflections included in the refinement: 0.1319
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No