Information card for entry 4327014

Structure parameters

• Formula: C18 H28 Cl4 N2 P2 U
• Calculated formula: C18 H28 Cl4 N2 P2 U
• SMILES: [U]12([P](CC[P]1(C)C)(C)C)([n]1ccc(cc1c1[n]2ccc(c1)C)C)(Cl)(Cl)(Cl)Cl
• Title of publication: Synthesis and Characterization of a Novel Tetranuclear 5f Compound: A New Synthon for Exploring U(IV) Chemistry
• Authors of publication: Brian S. Newell; Trevor C. Schwaab; Matthew P. Shores
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 12108 - 12115
• a: 9.2997 ± 0.0002 Å
• b: 14.4254 ± 0.0004 Å
• c: 18.5866 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2493.43 ± 0.11 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0323
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.0447
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No