Information card for entry 2233464

Structure parameters

• Chemical name: Methyl 3-<i>O</i>-α-L-fucopyranosyl α-D-galactopyranoside
• Formula: C13 H24 O10
• Calculated formula: C13 H24 O10
• SMILES: [C@@H]1([C@H]([C@@H]([C@@H]([C@@H](O1)C)O)O)O)O[C@@H]1[C@H]([C@@H](OC)O[C@@H]([C@@H]1O)CO)O
• Title of publication: Methyl 3-<i>O</i>-α-<small>L</small>-fucopyranosyl α-<small>D</small>-galactopyranoside: a synchrotron study
• Authors of publication: Eriksson, Lars; Widmalm, Göran
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 2
• Pages of publication: o528
• a: 4.78478 ± 0.00011 Å
• b: 15.7859 ± 0.0005 Å
• c: 19.4401 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1468.35 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0716
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1523
• Weighted residual factors for all reflections included in the refinement: 0.1766
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.907 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes