Information card for entry 1556132

Structure parameters

• Formula: C12 H17 N O6
• Calculated formula: C12 H17 N O6
• SMILES: O=C1OC[C@H]2N1[C@@H](C[C@H]1OC(O[C@@H]21)(C)C)C(=O)OC
• Title of publication: Stereodivergent synthesis of iminosugars from stannylated derivatives of (S)-vinylglycinol.
• Authors of publication: Lumbroso, Alexandre; Beaudet, Isabelle; Toupet, Loïc; Le Grognec, Erwan; Quintard, Jean-Paul
• Journal of publication: Organic letters
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 1
• Pages of publication: 160 - 163
• a: 8.2 ± 0.001 Å
• b: 10.542 ± 0.002 Å
• c: 14.773 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1277 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• 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: 0.0367
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0815
• Weighted residual factors for all reflections included in the refinement: 0.0844
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No