Information card for entry 7130509

Structure parameters

• Formula: C44 H66 B2 N12 O2 P U
• Calculated formula: C44 H66 B2 N12 O2 P U
• Title of publication: Isolation of uranium(iii) primary phosphido complexes
• Authors of publication: Perales, Diana; Bhowmick, Rina; Zeller, Matthias; Miro, Pere; Vlaisavljevich, Bess; Bart, Suzanne C.
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 10.1859 ± 0.0004 Å
• b: 19.3077 ± 0.0007 Å
• c: 24.7773 ± 0.001 Å
• α: 90°
• β: 92.876 ± 0.002°
• γ: 90°
• Cell volume: 4866.7 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0542
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No