Information card for entry 1577180

Structure parameters

• Formula: C15 H14 O3
• Calculated formula: C15 H14 O3
• Title of publication: Highly Cα-Regio-, Enantio-and Diastereoselective Mukaiyamatype Annulation of Siloxyfurans: Stereodivergent Synthesis of Multi-stereogenic Tricyclic γ-Lactones
• Authors of publication: Gan, Lifei; Li, Zi-Qing; Chen, Tao; Wan, Xuanchen; Zhang, Junyang; Ren, Jiangtao; Jiang, Ming; Cao, Penglong; Huang, Jinhai; Deng, Yu-Hua; Peng, Fangzhi; Tian, Run; Zhang, Zhi-Han; Wang, Yingcheng; Shao, Zhihui
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 5.1343 ± 0.0004 Å
• b: 9.3898 ± 0.0007 Å
• c: 12.4989 ± 0.001 Å
• α: 90°
• β: 100.387 ± 0.002°
• γ: 90°
• Cell volume: 592.7 ± 0.08 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.0875
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No