Information card for entry 4103687

Structure parameters

• Formula: C34 H38 F6 N2 O11 S2 U
• Calculated formula: C34 H38 F6 N2 O11 S2 U
• SMILES: [U]123([N](=Cc4c(O2)cccc4)c2ccccc2[N]1=Cc1ccccc1O3)([O]1CCCC1)([O]1CCCC1)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F.O1CCCC1
• Title of publication: Multielectron Redox Reactions Involving C-C Coupling and Cleavage in Uranium Schiff Base Complexes
• Authors of publication: Clément Camp; Victor Mougel; Pawel Horeglad; Jacques Pécaut; Marinella Mazzanti
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 17374 - 17377
• a: 15.209 ± 0.0013 Å
• b: 17.2523 ± 0.0014 Å
• c: 15.051 ± 0.001 Å
• α: 90°
• β: 99.689 ± 0.007°
• γ: 90°
• Cell volume: 3892.9 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1297
• Residual factor for significantly intense reflections: 0.0791
• Weighted residual factors for significantly intense reflections: 0.1866
• Weighted residual factors for all reflections included in the refinement: 0.2069
• Goodness-of-fit parameter for all reflections included in the refinement: 0.936
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No