Information card for entry 4070123

Structure parameters

• Formula: C25 H42 Si2 U
• Calculated formula: C25 H42 Si2 U
• SMILES: [U]123456789%10%11([c]%12([c]1([c]2(C)[c]8([c]7%12C)C)C)C)([CH]1=[CH]9[CH]%10=[CH]%11[CH]6=[CH]5[CH]4=[CH]31)C([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Synthesis and Insertion Chemistry of Monoalkyl and Monoaryl Uranium(IV) Heteroleptic Metallocene Complexes
• Authors of publication: Evans, William J.; Takase, Michael K.; Ziller, Joseph W.; Rheingold, Arnold L.
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 19
• Pages of publication: 5802
• a: 18.6588 ± 0.0018 Å
• b: 14.663 ± 0.0014 Å
• c: 9.254 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2531.8 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0175
• Residual factor for significantly intense reflections: 0.0143
• Weighted residual factors for significantly intense reflections: 0.0338
• Weighted residual factors for all reflections included in the refinement: 0.0352
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No