Information card for entry 1567208

Structure parameters

• Formula: C84 H198 K2 N9 O20 Si10 U2
• Calculated formula: C84 H198 K2 N9 O20 Si10 U2
• Title of publication: Nitrogen activation and cleavage by a multimetallic uranium complex.
• Authors of publication: Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella
• Journal of publication: Chemical science
• Year of publication: 2022
• Journal volume: 13
• Journal issue: 27
• Pages of publication: 8025 - 8035
• a: 13.8976 ± 0.0004 Å
• b: 14.741 ± 0.0004 Å
• c: 18.5692 ± 0.0004 Å
• α: 106.635 ± 0.002°
• β: 103.811 ± 0.002°
• γ: 95.243 ± 0.002°
• Cell volume: 3487.04 ± 0.17 ų
• Cell temperature: 139.99 ± 0.1 K
• Ambient diffraction temperature: 139.99 ± 0.1 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: 0.0634
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.1574
• Weighted residual factors for all reflections included in the refinement: 0.1614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No