Information card for entry 7160613

Structure parameters

• Formula: C32 H36 Cl N O4 Si
• Calculated formula: C32 H36 Cl N O4 Si
• Title of publication: Asymmetric [3 + 3] annulation of 3-hydroxyquinolin-2-ones <i>via</i> NHC organocatalysis.
• Authors of publication: Li, Heping; Yao, Weijun; Wang, Zhen
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 29
• Pages of publication: 6892 - 6896
• a: 9.5508 ± 0.0007 Å
• b: 11.5289 ± 0.0007 Å
• c: 28.804 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3171.6 ± 0.4 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 6
• 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: 0.0912
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.14
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No