Information card for entry 2208975

Structure parameters

• Chemical name: 2,3-Di-p-toluoyl-(2R,3R)-tartaric acid ethyl acetate solvate
• Formula: C24 H26 O10
• Calculated formula: C24 H26 O10
• SMILES: OC(=O)[C@H]([C@@H](C(=O)O)OC(=O)c1ccc(cc1)C)OC(=O)c1ccc(cc1)C.CCOC(=O)C
• Title of publication: 2,3-Di-<i>p</i>-toluoyl-(2<i>R</i>,3<i>R</i>)-tartaric acid ethyl acetate solvate
• Authors of publication: Li-Da Tang; Gui-Yun Duan; Da-Tong Zhang; Jian-Wu Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 5
• Pages of publication: o1685 - o1686
• a: 7.8516 ± 0.0013 Å
• b: 16.14 ± 0.003 Å
• c: 19.951 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2528.3 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.0575
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1121
• Weighted residual factors for all reflections included in the refinement: 0.1197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No