Information card for entry 7117746

Structure parameters

• Chemical name: Tp*2UF2
• Formula: C30 H43 B2 F2 N12 U
• Calculated formula: C30 H43 B2 F2 N12 U
• SMILES: [U]1234(F)(F)([n]5n(c(cc5C)C)[BH](n5[n]1c(cc5C)C)n1[n]2c(cc1C)C)[n]1n(c(cc1C)C)[BH](n1[n]3c(cc1C)C)n1[n]4c(cc1C)C
• Title of publication: Synthesis of low-valent uranium fluorides by C-F bond activation
• Authors of publication: Christopher L. Clark; Jill J. Lockhart; Phillip E. Fanwick; Suzanne C. Bart
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 14084
• a: 11.784 ± 0.0006 Å
• b: 22.3831 ± 0.001 Å
• c: 17.0603 ± 0.0007 Å
• α: 90°
• β: 93.165 ± 0.003°
• γ: 90°
• Cell volume: 4493 ± 0.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• 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: 0.0977
• Residual factor for significantly intense reflections: 0.0634
• Weighted residual factors for significantly intense reflections: 0.1728
• Weighted residual factors for all reflections included in the refinement: 0.1879
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No