Information card for entry 2230962

Structure parameters

• Chemical name: 3,6-Didehydro-5-hydroxy-1,2-<i>O</i>-isopropylidene-5-<i>C</i>-nitromethyl- α-D-glucofuranose
• Formula: C10 H15 N O7
• Calculated formula: C10 H15 N O7
• Title of publication: 3,6-Didehydro-5-hydroxy-1,2-<i>O</i>-isopropylidene-5-<i>C</i>-nitromethyl-α-<small>D</small>-glucofuranose
• Authors of publication: Zhang, Qiurong; Li, Pan; Chen, Xuebin; Wang, Xiandong; Liu, Hongmin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 7
• Pages of publication: o1673
• a: 5.6329 ± 0.00013 Å
• b: 8.36405 ± 0.00015 Å
• c: 25.4014 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1196.76 ± 0.04 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• 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: 0.0542
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.1626
• Weighted residual factors for all reflections included in the refinement: 0.1646
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes