Information card for entry 7123508

Structure parameters

• Formula: C21 H27 Fe N O Si
• Calculated formula: C21 H27 Fe N O Si
• Title of publication: Kinetically controlled asymmetric synthesis of silicon-stereogenic methoxy silanes using a planar chiral ferrocene backbone
• Authors of publication: Barth, Eva Rebecca; Krupp, Anna; Langenohl, Felix; Brieger, Lukas; Strohmann, Carsten
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 7.5129 ± 0.0008 Å
• b: 10.456 ± 0.0007 Å
• c: 24.907 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1956.6 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0241
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.0626
• Weighted residual factors for all reflections included in the refinement: 0.0627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No