Information card for entry 4106090

Structure parameters

• Formula: C37 H70 N3 P Si6 U
• Calculated formula: C37 H70 N3 P Si6 U
• SMILES: [U](N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)C=P(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis of a Phosphorano-Stabilized U(IV)-Carbene via One-Electron Oxidation of a U(III)-Ylide Adduct
• Authors of publication: Skye Fortier; Justin R. Walensky; Guang Wu; Trevor W. Hayton
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 6894 - 6897
• a: 10.822 ± 0.009 Å
• b: 11.711 ± 0.01 Å
• c: 19.296 ± 0.016 Å
• α: 83.326 ± 0.013°
• β: 89.784 ± 0.014°
• γ: 83.18 ± 0.012°
• Cell volume: 2412 ± 4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0809
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1091
• Goodness-of-fit parameter for all reflections included in the refinement: 0.923
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No