Information card for entry 7150935

Structure parameters

• Common name: diols
• Formula: C16 H23 N O4
• Calculated formula: C16 H23 N O4
• SMILES: O1C(O[C@@H]2CN(C[C@]([C@@H]12)(CO)O)Cc1ccccc1)(C)C
• Title of publication: Synthesis of polyhydroxy piperidines and their analogues: a novel approach towards selective inhibitors of α-glucosidase
• Authors of publication: Pandey, Ganesh; Bharadwaj, Kishor Chandra; Khan, M. Islam; Shashidhara, K. S.; Puranik, Vedavati G.
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2008
• Journal volume: 6
• Journal issue: 14
• Pages of publication: 2587 - 2595
• a: 10.9255 ± 0.0006 Å
• b: 5.6715 ± 0.0003 Å
• c: 12.9037 ± 0.0008 Å
• α: 90°
• β: 107.143 ± 0.001°
• γ: 90°
• Cell volume: 764.04 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0607
• Residual factor for significantly intense reflections: 0.0565
• Weighted residual factors for significantly intense reflections: 0.1142
• Weighted residual factors for all reflections included in the refinement: 0.1156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.175
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No