Information card for entry 1562344

Structure parameters

• Formula: C72 H162 I K2 N2 O24 Si6 U2
• Calculated formula: C72 H162 I1.002 K2 N2.004 O24 Si6 U2
• Title of publication: Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides
• Authors of publication: Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella
• Journal of publication: Chemical Science
• Year of publication: 2021
• a: 13.9014 ± 0.0003 Å
• b: 18.1586 ± 0.0005 Å
• c: 22.0984 ± 0.0005 Å
• α: 90°
• β: 92.822 ± 0.002°
• γ: 90°
• Cell volume: 5571.5 ± 0.2 ų
• Cell temperature: 140 ± 0.1 K
• Ambient diffraction temperature: 140 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1274
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No