Information card for entry 1564149

Structure parameters

• Formula: C24 H26 N2 O2 S
• Calculated formula: C24 H26 N2 O2 S
• SMILES: S(=O)(=O)(N[C@H]1CN([C@H]1c1ccccc1)[C@@H](C)c1ccccc1)c1cccc(c1)C
• Title of publication: Synthesis, structure and catalytic activity of organozinc complexes derived from chiral sulfonylamidoazetidines
• Authors of publication: Zhao, Hongyan; Zhang, Shaohui; Fang, Xiaojun; Chen, Liang; Ren, Wenshan
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 511
• Pages of publication: 119767
• a: 8.54575 ± 0.00008 Å
• b: 13.85892 ± 0.00012 Å
• c: 18.16386 ± 0.00014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2151.23 ± 0.03 ų
• Cell temperature: 149.7 ± 0.4 K
• Ambient diffraction temperature: 149.7 ± 0.4 K
• Number of distinct elements: 5
• 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: 0.027
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0706
• Weighted residual factors for all reflections included in the refinement: 0.0708
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No