Information card for entry 2235576

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-{[Ethane-1,2-diylbis(oxy)]bis(ethane-2,1-diyl)}bis(4- methylbenzenesulfonamide)
• Formula: C20 H28 N2 O6 S2
• Calculated formula: C20 H28 N2 O6 S2
• SMILES: Cc1ccc(cc1)S(=O)(=O)NCCOCCOCCNS(=O)(=O)c1ccc(cc1)C
• Title of publication: <i>N</i>,<i>N</i>'-{[Ethane-1,2-diylbis(oxy)]bis(ethane-2,1-diyl)}bis(4-methylbenzenesulfonamide)
• Authors of publication: Al-Mohammed, Nassir N.; Alias, Yatimah; Abdullah, Zanariah; Khaledi, Hamid
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: o1983
• a: 11.135 ± 0.007 Å
• b: 9.22 ± 0.006 Å
• c: 21.452 ± 0.015 Å
• α: 90°
• β: 93.68 ± 0.012°
• γ: 90°
• Cell volume: 2198 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0679
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.1504
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes