Information card for entry 4128543

Structure parameters

• Formula: C24 H20 Cl2 O4 S
• Calculated formula: C24 H20 Cl2 O4 S
• SMILES: Clc1ccc([C@H]([C@](Sc2ccccc2)(C(=O)OC)c2ccc(Cl)cc2)C(=O)OC)cc1.Clc1ccc([C@@H]([C@@](Sc2ccccc2)(C(=O)OC)c2ccc(Cl)cc2)C(=O)OC)cc1
• Title of publication: Glycosylation Enabled by Successive Rhodium(II) and Brønsted Acid Catalysis.
• Authors of publication: Meng, Lingkui; Wu, Peng; Fang, Jing; Xiao, Ying; Xiao, Xiong; Tu, Guangsheng; Ma, Xiang; Teng, Shuang; Zeng, Jing; Wan, Qian
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 30
• Pages of publication: 11775 - 11780
• a: 8.331 ± 0.0014 Å
• b: 11.358 ± 0.0019 Å
• c: 12.437 ± 0.002 Å
• α: 95.499 ± 0.005°
• β: 103.944 ± 0.005°
• γ: 90.227 ± 0.005°
• Cell volume: 1136.5 ± 0.3 ų
• Cell temperature: 206 ± 2 K
• Ambient diffraction temperature: 206 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1173
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1251
• Weighted residual factors for all reflections included in the refinement: 0.1637
• Goodness-of-fit parameter for all reflections included in the refinement: 1.264
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: cukα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No