Information card for entry 7122187

Structure parameters

• Formula: C150 H132 O18
• Calculated formula: C150 H132 O18
• Title of publication: Chiral Lewis acid-catalyzed enantioselective cyclopropanation and C-H insertion reactions of vinyl ketones with α-diazoesters.
• Authors of publication: Zhao, Peng; Wu, Simeng; Ke, Chaoqi; Liu, Xiaohua; Feng, Xiaoming
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 70
• Pages of publication: 9837 - 9840
• a: 16.42491 ± 0.00019 Å
• b: 18.47453 ± 0.00019 Å
• c: 20.7026 ± 0.0003 Å
• α: 90°
• β: 108.584 ± 0.0014°
• γ: 90°
• Cell volume: 5954.49 ± 0.14 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0629
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1333
• Weighted residual factors for all reflections included in the refinement: 0.1437
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No