Information card for entry 2219502

Structure parameters

• Chemical name: (<i>R</i>)-<i>N</i>-{2-<i>tert</i>-Butyl-2-[(<i>R</i>)-<i>tert</i>- butylsulfonamido]ethylidene}-<i>tert</i>-butanesulfonamide
• Formula: C14 H30 N2 O2 S2
• Calculated formula: C14 H30 N2 O2 S2
• SMILES: S(=O)(N[C@@H](/C=N/S(=O)C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: (<i>R</i>)-<i>N</i>-{2-<i>tert</i>-Butyl-2-[(<i>R</i>)-<i>tert</i>-butylsulfonamido]ethylidene}-<i>tert</i>-butanesulfonamide
• Authors of publication: Hu, Yu; Sun, Xiao-Xia; Fan, Cong-Bin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: o1913
• a: 9.714 ± 0.002 Å
• b: 18.489 ± 0.003 Å
• c: 11.169 ± 0.002 Å
• α: 90°
• β: 109.23 ± 0.01°
• γ: 90°
• Cell volume: 1894.1 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0576
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0835
• Goodness-of-fit parameter for all reflections included in the refinement: 0.925
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes