Information card for entry 4301861

Structure parameters

• Formula: C82 H78 B F15 N2 O4 U
• Calculated formula: C80.739 H64 B F15 N2 O4 U
• Title of publication: Exploring the Effects of Reduction or Lewis Acid Coordination on the U=O Bond of the Uranyl Moiety
• Authors of publication: Trevor W. Hayton; Guang Wu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 3065 - 3072
• a: 12.3274 ± 0.0013 Å
• b: 13.8548 ± 0.0015 Å
• c: 22.295 ± 0.002 Å
• α: 86.873 ± 0.002°
• β: 85.589 ± 0.002°
• γ: 86.192 ± 0.002°
• Cell volume: 3783.5 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0892
• Residual factor for significantly intense reflections: 0.0614
• Weighted residual factors for significantly intense reflections: 0.1451
• Weighted residual factors for all reflections included in the refinement: 0.1658
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No