Information card for entry 7134479

Structure parameters

• Formula: C16 H16 O2
• Calculated formula: C16 H16 O2
• Title of publication: Stereoselective synthesis of C-glycosides from glycals and organotrifluoroborate salts
• Authors of publication: Othman, Karwan Abdulmajed; Xiang, Yimin; Wang, Yue; Huang, Nianyu; Wang, Nengzhong; Li, Linxuan; Yao, Hui
• Journal of publication: Chemical Communications
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 43
• Pages of publication: 7867 - 7870
• a: 8.6971 ± 0.0006 Å
• b: 5.873 ± 0.0004 Å
• c: 12.5155 ± 0.0009 Å
• α: 90°
• β: 94.239 ± 0.007°
• γ: 90°
• Cell volume: 637.52 ± 0.08 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 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: 0.0609
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1545
• Weighted residual factors for all reflections included in the refinement: 0.1576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No