Information card for entry 7154647

Structure parameters

• Common name: Fluoroalkene 11
• Chemical name: 3-?-(2?, 3?, 4?, 6?-?-Tetra-?-O-?-benzyl-?-α-?-D-?- galactopyranosyl)-?-3-?-R-?-fluoropropene
• Formula: C37 H39 F O5
• Calculated formula: C37 H39 F O5
• SMILES: [C@@H]1([C@H]([C@@H]([C@@H]([C@H](COCc2ccccc2)O1)OCc1ccccc1)OCc1ccccc1)OCc1ccccc1)[C@H](C=C)F
• Title of publication: An organocatalytic strategy for the stereoselective synthesis of C-galactosides with fluorine at the pseudoanomeric carbon.
• Authors of publication: Altiti, Ahmad S.; Bachan, S.; Alrowhani, W.; Mootoo, D. R.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2015
• Journal volume: 13
• Journal issue: 41
• Pages of publication: 10328 - 10335
• a: 12.036 ± 0.005 Å
• b: 10.533 ± 0.005 Å
• c: 12.239 ± 0.005 Å
• α: 90°
• β: 94.749 ± 0.01°
• γ: 90°
• Cell volume: 1546.3 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0928
• Residual factor for significantly intense reflections: 0.0655
• Weighted residual factors for significantly intense reflections: 0.1604
• Weighted residual factors for all reflections included in the refinement: 0.1831
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9821
• Diffraction radiation wavelength: 0.71095 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No