Information card for entry 2011330

Structure parameters

• Common name: 1,6-Anhydro-2,3-di-O-Benzyl-5C-(Carbethoxy-1(R)-hydroxymethyl)-L-altrofuranose
• Chemical name: 1,6-Anhydro-2,3-di-O-benzyl-5C-[(R)-ethoxycarbonyl(hydroxy)methyl]-L- altrofuranose
• Formula: C24 H28 O8
• Calculated formula: C24 H28 O8
• SMILES: O1[C@@H]2[C@@H]([C@H]([C@@H](O2)[C@](C1)(O)[C@@H](O)C(=O)OCC)OCc1ccccc1)OCc1ccccc1
• Title of publication: 1,6-Anhydro-2,3-di-<i>O</i>-benzyl-5<i>C</i>-[(<i>R</i>)-ethoxycarbonyl(hydroxy)methyl]-β-<small>L</small>-altrofuranose
• Authors of publication: Taillefumier, Claude; Charron, Christophe; Chapleur, Yves; Aubry, Andre
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 9
• Pages of publication: 1168 - 1169
• a: 5.674 ± 0.0014 Å
• b: 11.699 ± 0.006 Å
• c: 33.534 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2226 ± 1.3 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: 0.064
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.148
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes