Information card for entry 4320730

Structure parameters

• Formula: C33 H75 I2 O10.5 U Zr2
• Calculated formula: C33 H71 I2 O10.5 U Zr2
• Title of publication: Synthesis of Arene-Soluble Mixed-Metal Uranium/Zirconium Complexes Using the Dizirconium Nonaisopropoxide Ligand
• Authors of publication: William J. Evans; Gregory W. Nyce; Michael A. Greci; Joseph W. Ziller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 6725 - 6730
• a: 12.5451 ± 0.0011 Å
• b: 21.4149 ± 0.0019 Å
• c: 18.2977 ± 0.0016 Å
• α: 90°
• β: 104.252 ± 0.002°
• γ: 90°
• Cell volume: 4764.4 ± 0.7 ų
• Cell temperature: 158 ± 2 K
• Ambient diffraction temperature: 158 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0456
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0584
• Weighted residual factors for all reflections included in the refinement: 0.0623
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No