Information card for entry 4308882

Structure parameters

• Formula: C18 H26 Cl2 U
• Calculated formula: C18 H26 Cl2 U
• SMILES: [cH]1([c]2([c]3(C)[c]4([c]15C)C)C)[U]16782345([cH]2[c]1([c]6(C)[c]7([c]28C)C)C)(Cl)Cl
• Title of publication: Facile Syntheses of Unsolvated UI3 and Tetramethylcyclopentadienyl Uranium Halides
• Authors of publication: William J. Evans; Stosh A. Kozimor; Joseph W. Ziller; Anatolii A. Fagin; Mikhail N. Bochkarev
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 3993 - 4000
• a: 17.7866 ± 0.0016 Å
• b: 6.7022 ± 0.0006 Å
• c: 15.654 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1866.1 ± 0.3 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 4
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0126
• Residual factor for significantly intense reflections: 0.0121
• Weighted residual factors for significantly intense reflections: 0.029
• Weighted residual factors for all reflections included in the refinement: 0.0292
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No