Information card for entry 2005042

Structure parameters

• Common name: 1-O-benzyl-β-L-arabinopyranose
• Chemical name: 1-O-benzyl-β-L-arabinopyranose
• Formula: C12 H16 O5
• Calculated formula: C12 H16 O5
• SMILES: O([C@H]1OC[C@H](O)[C@H](O)[C@H]1O)Cc1ccccc1
• Title of publication: 1-<i>O</i>-Benzyl-β-<small>L</small>-arabinopyranose, 1-<i>O</i>-Benzyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose and 1-<i>O</i>-Benzyl-2-<i>O</i>-benzoyl-3,4-<i>O</i>-isopropylidene-β-<small>L</small>-arabinopyranose
• Authors of publication: Popek, T.; Mazurek, J.; Lis, T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 6
• Pages of publication: 1558 - 1563
• a: 5.858 ± 0.003 Å
• b: 8.171 ± 0.003 Å
• c: 24.367 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1166.3 ± 0.8 ų
• Cell temperature: 293 ± 1 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: 0.0426
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for all reflections: 0.095
• Weighted residual factors for significantly intense reflections: 0.0913
• Goodness-of-fit parameter for all reflections: 1.041
• Goodness-of-fit parameter for significantly intense reflections: 1.102
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No