Information card for entry 4318070

Structure parameters

• Chemical name: Bis-m-2,6-dimethylphenoxy-bis[chloro(dioxo)bis (tetrahydrofuran)uranium(VI)]
• Formula: C32 H50 Cl2 O10 U2
• Calculated formula: C32 Cl2 O10 U2
• SMILES: [U]1([O](c2c(cccc2C)C)[U](Cl)([O]1c1c(cccc1C)C)(=O)(=O)([O]1CCCC1)[O]1CCCC1)(Cl)(=O)(=O)([O]1CCCC1)[O]1CCCC1
• Title of publication: Steric Control of Substituted Phenoxide Ligands on Product Structures of Uranyl Aryloxide Complexes
• Authors of publication: Marianne P. Wilkerson; Carol J. Burns; David E. Morris; Robert T. Paine; Brian L. Scott
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 3110 - 3120
• a: 13.9 ± 0.04 Å
• b: 13.39 ± 0.05 Å
• c: 23.05 ± 0.06 Å
• α: 90°
• β: 93.14 ± 0.09°
• γ: 90°
• Cell volume: 4284 ± 2 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• 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: 0.1291
• Residual factor for significantly intense reflections: 0.116
• Weighted residual factors for significantly intense reflections: 0.3161
• Weighted residual factors for all reflections included in the refinement: 0.3247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.556
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No