Information card for entry 4119166

Structure parameters

• Formula: C18 H54 Cl N3 O Si6 U
• Calculated formula: C18 H54 Cl N3 O Si6 U
• SMILES: [U](Cl)(=O)(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
• Title of publication: Reductive Cleavage of Nitrite to Form Terminal Uranium Mono-Oxo Complexes
• Authors of publication: Andrew J. Lewis; Patrick J. Carroll; Eric J. Schelter
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 511 - 518
• a: 11.8692 ± 0.0004 Å
• b: 12.5376 ± 0.0004 Å
• c: 22.9317 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3412.5 ± 0.2 ų
• Cell temperature: 143 ± 1 K
• Ambient diffraction temperature: 143 ± 1 K
• Number of distinct elements: 7
• 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: 0.0216
• Residual factor for significantly intense reflections: 0.017
• Weighted residual factors for significantly intense reflections: 0.03
• Weighted residual factors for all reflections included in the refinement: 0.0307
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No