Information card for entry 7713323

Structure parameters

• Formula: C23 H20 Cl2 Cu N4 O3 S
• Calculated formula: C23 H20 Cl2 Cu N4 O3 S
• SMILES: [Cu]12(Cl)(Cl)[n]3ccccc3c3[n]1c(cc(OCCNS(=O)(=O)c1ccccc1)c3)c1[n]2cccc1
• Title of publication: Cancer stem cell activity of copper(II)-terpyridine complexes with aryl sulfonamide groups.
• Authors of publication: Singh, Karampal; Northcote-Smith, Joshua; Singh, Kuldip; Suntharalingam, Kogularamanan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 14.013 ± 0.003 Å
• b: 13.767 ± 0.003 Å
• c: 24.041 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4637.9 ± 1.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0622
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.0909
• Weighted residual factors for all reflections included in the refinement: 0.0967
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No