Information card for entry 7006620

Structure parameters

• Formula: C88 H123 B2 O11 Si Y
• Calculated formula: C88 H123 B2 O11 Si Y
• SMILES: [Y](O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C)([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)[O]1CCCC1.O1CCCC1.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis, structure and hydrosilylation activity of neutral and cationic rare-earth metal silanolate complexes.
• Authors of publication: Elvidge, Benjamin R.; Arndt, Stefan; Spaniol, Thomas P.; Okuda, Jun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 7
• Pages of publication: 890 - 901
• a: 13.05 ± 0.0012 Å
• b: 25.186 ± 0.002 Å
• c: 25.083 ± 0.002 Å
• α: 90°
• β: 94.606 ± 0.002°
• γ: 90°
• Cell volume: 8217.6 ± 1.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1011
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.0969
• Weighted residual factors for all reflections included in the refinement: 0.1144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No