Information card for entry 2226213

Structure parameters

• Chemical name: 6-Deoxy-6-fluoro-D-galactose
• Formula: C6 H11 F O5
• Calculated formula: C6 H11 F O5
• SMILES: FC[C@H]1O[C@H](O)[C@H](O)[C@H]([C@H]1O)O
• Title of publication: 6-Deoxy-6-fluoro-<small>D</small>-galactose
• Authors of publication: Jenkinson, Sarah F.; Best, Daniel; Izumori, Ken; Wilson, Francis X.; Weymouth-Wilson, Alexander C.; Fleet, George W. J.; Thompson, Amber L.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: o1315
• a: 6.7928 ± 0.0003 Å
• b: 7.5822 ± 0.0003 Å
• c: 14.1165 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 727.06 ± 0.05 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0555
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for all reflections: 0.1193
• Weighted residual factors for significantly intense reflections: 0.116
• Weighted residual factors for all reflections included in the refinement: 0.1193
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes