Information card for entry 4102060

Structure parameters

• Common name: (u-N)(U(N[t-Bu][3,5-Me2C6H3]3)2
• Formula: C76 H118 N7 O U2
• Calculated formula: C76 H118 N7 O U2
• Title of publication: Uranium-Nitrogen Multiple Bonding: Isostructural Anionic, Neutral, and Cationic Uranium Nitride Complexes Featuring a Linear U=N=U Core
• Authors of publication: Alexander R. Fox; Polly L. Arnold; Christopher C. Cummins
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 3250 - 3251
• a: 11.9403 ± 0.0008 Å
• b: 13.8787 ± 0.0009 Å
• c: 13.8923 ± 0.0016 Å
• α: 111.12 ± 0.001°
• β: 101.095 ± 0.002°
• γ: 105.745 ± 0.001°
• Cell volume: 1956 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.0798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No