Information card for entry 4329084

Structure parameters

• Formula: C84 H48 Ni8 O118.72 P16 U12
• Calculated formula: C84 H48 Ni8 O118.72 P16 U12
• Title of publication: Uranyl Heteropolyoxometalate: Synthesis, Structure, and Spectroscopic Properties
• Authors of publication: Pius O. Adelani; Allen G. Oliver; Thomas E. Albrecht-Schmitt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4885 - 4887
• a: 36.38 ± 0.003 Å
• b: 36.38 ± 0.003 Å
• c: 36.38 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 48149 ± 7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 219
• Hermann-Mauguin space group symbol: F -4 3 c
• Hall space group symbol: F -4a 2 3
• Residual factor for all reflections: 0.0519
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No