Information card for entry 7125907

Structure parameters

• Formula: C20 H17.27 Cl N O2
• Calculated formula: C20 H17.2735 Cl N O2
• Title of publication: Highly enantioselective electrosynthesis of C2-quaternary indolin-3-ones.
• Authors of publication: Lu, Fo-Yun; Chen, Yu-Jue; Chen, Yuan; Ding, Xuan; Guan, Zhi; He, Yan-Hong
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 4
• Pages of publication: 623 - 626
• a: 10.0005 ± 0.0001 Å
• b: 15.089 ± 0.0001 Å
• c: 23.6172 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3563.78 ± 0.05 ų
• Cell temperature: 278 ± 30 K
• Ambient diffraction temperature: 278 ± 30 K
• Number of distinct elements: 5
• 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: 0.0395
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.1011
• Weighted residual factors for all reflections included in the refinement: 0.1034
• 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