Information card for entry 7150839

Structure parameters

• Common name: Tetracyclic compounds
• Formula: C10 H14 N4 O4
• Calculated formula: C10 H14 N4 O4
• SMILES: O1[C@@H]2OC(O[C@@H]2[C@H]2OCc3nnnn3C[C@@H]12)(C)C
• Title of publication: Synthesis of 1,2,3-triazole and 1,2,3,4-tetrazole-fused glycosides and nucleosides by an intramolecular 1,3-dipolar cycloaddition reaction
• Authors of publication: Anegundi, Ramakrishna I.; Puranik, Vedavati G.; Hotha, Srinivas
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2008
• Journal volume: 6
• Journal issue: 4
• Pages of publication: 779 - 786
• a: 5.6672 ± 0.0005 Å
• b: 9.8214 ± 0.0009 Å
• c: 21.2188 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1181.03 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0478
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.0935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No