Information card for entry 2001922

Structure parameters

• Formula: C19 H20 N2 O10 S
• Calculated formula: C19 H17 N2 O10 S
• SMILES: S(c1nc2oc(=O)cc(c2c(=O)[nH]1)C)[C@@H]1[C@@H]([C@H]([C@H](CO1)OC(=O)C)OC(=O)C)OC(=O)C
• Title of publication: An original linkage between arabinose and a pyranopyrimidine derivative <i>via</i> a sulfur atom
• Authors of publication: Tomas, A.; Dung, Nguyen-Huy; Viossat, B.; Esanu, A.; Rolland, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 3
• Pages of publication: 626 - 628
• a: 9.202 ± 0.001 Å
• b: 10.716 ± 0.002 Å
• c: 22.111 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2180.3 ± 0.6 ų
• Cell temperature: 295 ± 2 K
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.047
• Goodness-of-fit parameter for significantly intense reflections: 2
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No