Information card for entry 2228551

Structure parameters

• Chemical name: 1,2,3-Tri-<i>O</i>-acetyl-5-deoxy-D-ribofuranose
• Formula: C11 H16 O7
• Calculated formula: C11 H16 O7
• SMILES: O1[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1C
• Title of publication: 1,2,3-Tri-<i>O</i>-acetyl-5-deoxy-<small>D</small>-ribofuranose
• Authors of publication: Tang, Wen-Jian; Lin, Zhi-Cai; Tang, Min-Fang; Li, Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: o3107
• a: 7.592 ± 0.002 Å
• b: 8.505 ± 0.002 Å
• c: 20.445 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1320.1 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0796
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1049
• Weighted residual factors for all reflections included in the refinement: 0.1332
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes