Information card for entry 2239352

Structure parameters

• Chemical name: Methyl 4-<i>O</i>-benzyl-α-<i>L</i>-rhamnopyranoside
• Formula: C14 H20 O5
• Calculated formula: C14 H20 O5
• SMILES: CO[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)OCc1ccccc1
• Title of publication: Methyl 4-<i>O</i>-benzyl-α-<small>L</small>-rhamnopyranoside
• Authors of publication: Pendrill, Robert; Eriksson, Lars; Widmalm, Göran
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 5
• Pages of publication: o561 - o562
• a: 6.5377 ± 0.0001 Å
• b: 9.1848 ± 0.0002 Å
• c: 23.2699 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1397.3 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0446
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0782
• Weighted residual factors for all reflections included in the refinement: 0.0814
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes