Information card for entry 2226567

Structure parameters

• Chemical name: (4<i>S</i>)-4-Benzyl-<i>N</i>-{[(4<i>S</i>)-4-benzyl-2-oxo-1,3-oxazolidin- 3-yl]sulfonyl}-2-oxo-1,3-oxazolidine-3-carboxamide
• Formula: C21 H21 N3 O7 S
• Calculated formula: C21 H21 N3 O7 S
• SMILES: S(=O)(=O)(N1[C@@H](Cc2ccccc2)COC1=O)NC(=O)N1[C@H](COC1=O)Cc1ccccc1
• Title of publication: (4<i>S</i>)-4-Benzyl-<i>N</i>-{[(4<i>S</i>)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]sulfonyl}-2-oxo-1,3-oxazolidine-3-carboxamide
• Authors of publication: Berredjem, Malika; Allaoui, Assia; Direm, Amani; Aouf, Noureddine; Benali-Cherif, Nourredine
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1611 - o1612
• a: 10.4262 ± 0.0003 Å
• b: 9.7171 ± 0.0002 Å
• c: 10.7402 ± 0.0002 Å
• α: 90°
• β: 101.504 ± 0.002°
• γ: 90°
• Cell volume: 1066.26 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0841
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes