Information card for entry 1576498

Structure parameters

• Formula: C36 H40 O4 S2
• Calculated formula: C36 H40 O4 S2
• Title of publication: Diastereoselective synthesis of cyclopropyl sulfoxides <i>via</i> hydrosulfenation.
• Authors of publication: Yuwen, Liyan; Tang, Jiazhong; Qi, Yayu; Zou, Tianyi; Zhang, Shaotong; Zhang, Ya-Qian; Zhang, Qing-Wei
• Journal of publication: Chemical science
• Year of publication: 2026
• Journal volume: 17
• Journal issue: 6
• Pages of publication: 3171 - 3177
• a: 5.918 ± 0.0003 Å
• b: 8.0256 ± 0.0004 Å
• c: 16.8884 ± 0.0009 Å
• α: 90°
• β: 98.632 ± 0.002°
• γ: 90°
• Cell volume: 793.04 ± 0.07 ų
• Cell temperature: 170 K
• Ambient diffraction temperature: 170 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: 0.05
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No