Information card for entry 4309737

Structure parameters

• Formula: C17 H25 B I3 N7 U
• Calculated formula: C17 H25 B I3 N7 U
• SMILES: [BH]12n3[n]([U](I)(I)(I)([N]#CC)([n]4n1c(cc4C)C)[n]1n2c(cc1C)C)c(cc3C)C
• Title of publication: Uranium(III)/(IV) Nitrile Adducts Including UI4(N\τbCPh)4, a Synthetically Useful Uranium(IV) Complex
• Authors of publication: Alejandro E. Enriquez; Brian L. Scott; Mary P. Neu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 7403 - 7413
• a: 14.538 ± 0.004 Å
• b: 10.323 ± 0.003 Å
• c: 17.448 ± 0.005 Å
• α: 90°
• β: 99.301 ± 0.005°
• γ: 90°
• Cell volume: 2584.1 ± 1.3 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.0893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.359
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No