Information card for entry 1570264

Structure parameters

• Formula: C112 H242 K2.8 N4 O42.8 Si7.2 U2.54
• Calculated formula: C112 H242 K2.8 N4 O42.8 Si7.2 U2.54
• Title of publication: Dinitrogen cleavage by a dinuclear uranium(iii) complex.
• Authors of publication: Jori, Nadir; Keener, Megan; Rajeshkumar, Thayalan; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 46
• Pages of publication: 13485 - 13494
• a: 18.1765 ± 0.0003 Å
• b: 24.9651 ± 0.0005 Å
• c: 32.6981 ± 0.0006 Å
• α: 90°
• β: 90.4373 ± 0.0017°
• γ: 90°
• Cell volume: 14837.3 ± 0.5 ų
• Cell temperature: 140 ± 0.1 K
• Ambient diffraction temperature: 140 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1323
• Residual factor for significantly intense reflections: 0.0939
• Weighted residual factors for significantly intense reflections: 0.2434
• Weighted residual factors for all reflections included in the refinement: 0.2752
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No