Information card for entry 4335586

Structure parameters

• Formula: C12 H12 N2 O8 P2 U Zn
• Calculated formula: C12 H12 N2 O8 P2 U Zn
• Title of publication: Flexible Diphosphonic Acids for the Isolation of Uranyl Hybrids with Heterometallic UVI=O-ZnII Cation-Cation Interactions
• Authors of publication: Tao Tian; Weiting Yang; Hao Wang; Song Dang; Zhong-Ming Sun
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 8288 - 8290
• a: 10.3814 ± 0.0009 Å
• b: 21.4752 ± 0.0018 Å
• c: 8.0597 ± 0.0007 Å
• α: 90°
• β: 100.074 ± 0.002°
• γ: 90°
• Cell volume: 1769.1 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• 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: 0.0504
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0741
• Weighted residual factors for all reflections included in the refinement: 0.0784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No