Information card for entry 1570169

Structure parameters

• Formula: C33 H50 O2 U
• Calculated formula: C33 H50 O2 U
• Title of publication: Cooperative dihydrogen activation with unsupported uranium-metal bonds and characterization of a terminal U(iv) hydride.
• Authors of publication: Ward, Robert J.; Rungthanaphatsophon, Pokpong; Huang, Patrick; Kelley, Steven P.; Walensky, Justin R.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 43
• Pages of publication: 12255 - 12263
• a: 10.0523 ± 0.0008 Å
• b: 11.2703 ± 0.0009 Å
• c: 14.4867 ± 0.0011 Å
• α: 91.227 ± 0.003°
• β: 106.016 ± 0.003°
• γ: 95.893 ± 0.003°
• Cell volume: 1567.1 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0474
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0688
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No