Information card for entry 4133162

Structure parameters

• Formula: C49.5 H111.5 Cr2 I O16 Si4
• Calculated formula: C49.5 H111.5 Cr2 I O16 Si4
• Title of publication: Unveiling the Takai Olefination Reagent via Tris( tert-butoxy)siloxy Variants.
• Authors of publication: Werner, Daniel; Anwander, Reiner
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 43
• Pages of publication: 14334 - 14341
• a: 13.319 ± 0.0008 Å
• b: 13.6739 ± 0.0008 Å
• c: 21.8226 ± 0.0013 Å
• α: 80.7633 ± 0.0009°
• β: 80.5611 ± 0.0009°
• γ: 62.7355 ± 0.0009°
• Cell volume: 3468.4 ± 0.4 ų
• Cell temperature: 100.1 K
• Ambient diffraction temperature: 100.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0964
• Weighted residual factors for all reflections included in the refinement: 0.1144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No