Information card for entry 7150702

Structure parameters

• Common name: quinolizidine
• Formula: C13 H23 N O4
• Calculated formula: C13 H23 N O4
• SMILES: O1C(O[C@H]2CN3CCCC[C@@H]3[C@]([C@H]12)(O)CO)(C)C
• Title of publication: Synthesis of polyfunctional quinolizidine alkaloids: development towards selective glycosidase inhibitors
• Authors of publication: Pandey, Ganesh; Grahacharya, Debasish; Shashidhara, K. S.; Khan, M. Islam; Puranik, Vedavati G.
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2009
• Journal volume: 7
• Journal issue: 16
• Pages of publication: 3300 - 3307
• a: 5.3743 ± 0.0004 Å
• b: 10.2506 ± 0.0007 Å
• c: 24.3106 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1339.27 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0435
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0856
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No