Information card for entry 2009008

Structure parameters

• Chemical name: 4-O-benzyl-2,3-O-isopropylidene-α-L-rhamnopyranose
• Formula: C16 H22 O5
• Calculated formula: C16 H22 O5
• SMILES: [C@H]1(O)[C@H]2[C@@H]([C@@H](OCc3ccccc3)[C@@H](O1)C)OC(O2)(C)C
• Title of publication: 4-<i>O</i>-Benzyl-2,3-<i>O</i>-isopropylidene-α-<small>L</small>-rhamnopyranose
• Authors of publication: Eriksson, Lars; Söderman, Peter; Widmalm, Göran
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 10
• Pages of publication: 1736 - 1738
• a: 8.626 ± 0.002 Å
• b: 6.5402 ± 0.0012 Å
• c: 14.524 ± 0.004 Å
• α: 90°
• β: 100.21 ± 0.03°
• γ: 90°
• Cell volume: 806.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.201
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for all reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections: 0.715
• Goodness-of-fit parameter for all reflections included in the refinement: 0.715
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No