Information card for entry 4135619

Structure parameters

• Formula: C25 H29 N O4 S Si
• Calculated formula: C25 H29 N O4 S Si
• Title of publication: Rh(I)-Catalyzed Carbene Migration/Carbonylation/Cyclization: Straightforward Construction of Fully Substituted Aryne Precursors.
• Authors of publication: Zhu, Guohao; Gao, Wen-Chao; Jiang, Xuefeng
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2021
• Journal volume: 143
• Journal issue: 3
• Pages of publication: 1334 - 1340
• a: 12.3097 ± 0.0001 Å
• b: 14.4416 ± 0.0001 Å
• c: 13.6087 ± 0.0001 Å
• α: 90°
• β: 101.087 ± 0.001°
• γ: 90°
• Cell volume: 2374.09 ± 0.03 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0312
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0788
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No