Information card for entry 1100823

Structure parameters

• Formula: C31 H51 Si2 Y
• Calculated formula: C31 H51 Si2 Y
• Title of publication: Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands
• Authors of publication: Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 10
• Pages of publication: 2269 - 2278
• a: 10.0582 ± 0.0005 Å
• b: 10.9779 ± 0.0006 Å
• c: 28.1698 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3110.5 ± 0.3 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0681
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.0861
• Weighted residual factors for all reflections included in the refinement: 0.0968
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No