Information card for entry 4107684

Structure parameters

• Formula: C36 H55 N O U
• Calculated formula: C36 H55 N O U
• SMILES: [U]12345678([O]9CCCC9)([c]9([c]2([c]5([c]4([c]19C)C)C)C)C)([c]1([c]3([c]7(C)[c]8([c]61C)C)C)C)=Nc1c(C(C)C)cccc1C(C)C
• Title of publication: Organometallic Uranium(V)-Imido Halide Complexes: From Synthesis to Electronic Structure and Bonding
• Authors of publication: Christopher R. Graves; Ping Yang; Stosh A. Kozimor; Anthony E. Vaughn; David L. Clark; Steven D. Conradson; Eric J. Schelter; Brian L. Scott; J. D. Thompson; P. Jeffrey Hay; David E. Morris; Jaqueline L. Kiplinger
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 5272 - 5285
• a: 11.8607 ± 0.0011 Å
• b: 17.2023 ± 0.0017 Å
• c: 32.273 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6584.7 ± 1.1 ų
• Cell temperature: 141 ± 2 K
• Ambient diffraction temperature: 141 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0896
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0656
• Weighted residual factors for all reflections included in the refinement: 0.078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No