Information card for entry 4026824

Structure parameters

• Formula: C20 H26 O6
• Calculated formula: C20 H26 O6
• Title of publication: Unexpected Anomeric Selectivity of a 1-C-Arylglycal Donor in Kdo Glycoside Synthesis
• Authors of publication: Yuxin Qian; Jianhao Feng; Masood Parvez; Chang-Chun Ling
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2012
• Journal volume: 77
• Pages of publication: 96 - 107
• a: 5.3633 ± 0.0002 Å
• b: 11.0398 ± 0.0004 Å
• c: 32.0423 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1897.22 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• 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: 0.0975
• Residual factor for significantly intense reflections: 0.0788
• Weighted residual factors for significantly intense reflections: 0.1756
• Weighted residual factors for all reflections included in the refinement: 0.1905
• Goodness-of-fit parameter for all reflections included in the refinement: 1.21
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No