Information card for entry 4309732

Structure parameters

• Formula: C18 H27 I7 N9 U2
• Calculated formula: C18 H18 I7 N9 U2
• SMILES: C(#N)C.C(#[N][U]([N]#CC)([N]#CC)([N]#CC)([N]#CC)[N]#CC)C.I[U](I)(I)(I)(I)I.[I-].C(#N)C.C(#N)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: 10.9169 ± 0.0019 Å
• b: 10.9169 ± 0.0019 Å
• c: 21.622 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2231.6 ± 0.8 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• Space group number: 188
• Hermann-Mauguin space group symbol: P -6 c 2
• Hall space group symbol: P -6c 2
• Residual factor for all reflections: 0.0749
• Residual factor for significantly intense reflections: 0.0694
• Weighted residual factors for significantly intense reflections: 0.2141
• Weighted residual factors for all reflections included in the refinement: 0.2167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.867
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No