Information card for entry 1575000

Structure parameters

• Formula: C50 H86 N4 O4 U
• Calculated formula: C42 H70 N4 O2 U
• Title of publication: Facile N-C bond cleavage and arene reduction by a transient uranium(ii) complex.
• Authors of publication: Shivaraam, R. A. Keerthi; Maria, Leonor; Rajeshkumar, Thayalan; Scopelliti, Rosario; Živković, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 31
• Pages of publication: 14242 - 14251
• a: 16.1897 ± 0.0004 Å
• b: 15.6587 ± 0.0006 Å
• c: 19.7929 ± 0.0008 Å
• α: 90°
• β: 96.971 ± 0.003°
• γ: 90°
• Cell volume: 4980.6 ± 0.3 ų
• Cell temperature: 140 ± 0.1 K
• Ambient diffraction temperature: 140 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.1021
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1386
• Weighted residual factors for all reflections included in the refinement: 0.1589
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No