Information card for entry 7128132

Structure parameters

• Formula: C23 H25 F O
• Calculated formula: C23 H25 F O
• Title of publication: Enantioselective nickel-catalyzed <i>anti</i>-arylmetallative cyclizations onto acyclic electron-deficient alkenes.
• Authors of publication: Gillbard, Simone M.; Green, Harley; Argent, Stephen P.; Lam, Hon Wai
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 36
• Pages of publication: 4436 - 4439
• a: 12.2119 ± 0.0001 Å
• b: 5.6331 ± 0.0001 Å
• c: 14.2712 ± 0.0001 Å
• α: 90°
• β: 106.598 ± 0.001°
• γ: 90°
• Cell volume: 940.82 ± 0.02 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0719
• Weighted residual factors for all reflections included in the refinement: 0.0722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No