Information card for entry 7111155

Structure parameters

• Formula: C71.5 H129 O12 Si9 Ti
• Calculated formula: C71.5 H125 O12 Si9 Ti
• Title of publication: A novel route to advanced model systems for silica-immobilized olefin polymerization catalysts
• Authors of publication: Edelmann, Frank T.; Gießmann, Stephan; Fischer, Axel
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 21
• Pages of publication: 2153
• a: 13.087 ± 0.0006 Å
• b: 26.1626 ± 0.0003 Å
• c: 24.449 ± 0.001 Å
• α: 90°
• β: 97.616 ± 0.003°
• γ: 90°
• Cell volume: 8297.2 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.086
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1355
• Weighted residual factors for all reflections included in the refinement: 0.1532
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No