Information card for entry 4109970

Structure parameters

• Formula: C33 H47 F3 N O3 S U
• Calculated formula: C33 H47 F3 N O3 S U
• SMILES: [U]12345678(OS(=O)(=O)C(F)(F)F)(=Nc9c(cccc9C(C)C)C(C)C)([c]9([c]4([c]3([c]2([c]19C)C)C)C)C)[c]1([c]5([c]6([c]7([c]81C)C)C)C)C
• Title of publication: Facile Access to Pentavalent Uranium Organometallics: One-Electron Oxidation of Uranium(IV) Imido Complexes with Copper(I) Salts
• Authors of publication: Christopher R. Graves; Brian L. Scott; David E. Morris; Jaqueline L. Kiplinger
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 11914 - 11915
• a: 10.005 ± 0.002 Å
• b: 10.514 ± 0.002 Å
• c: 17.37 ± 0.004 Å
• α: 76.628 ± 0.002°
• β: 77.703 ± 0.002°
• γ: 68.935 ± 0.002°
• Cell volume: 1641.8 ± 0.6 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 120 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No