Information card for entry 7161127

Structure parameters

• Formula: C32 H28 N4 O2 S
• Calculated formula: C32 H28 N4 O2 S
• Title of publication: Crab-shaped tridentate HoQ-Sulidines as bifunctional anionic ligands: empowering asymmetric addition reactions of indoles with β,γ-unsaturated α-ketoesters.
• Authors of publication: Hu, Zi-Hong; Liu, Xiong-Wei; Geng, Wen-Xiu; Wang, Ning; Yao, Zhen; Li, Rui-Rui; Zhang, Wen-Hui; Liu, Xiong-Li
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2026
• Journal volume: 24
• Journal issue: 19
• Pages of publication: 4010 - 4015
• a: 9.2275 ± 0.0001 Å
• b: 16.6465 ± 0.0001 Å
• c: 17.3955 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2672.05 ± 0.04 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0284
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.0732
• Weighted residual factors for all reflections included in the refinement: 0.0737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No