Information card for entry 7057577

Structure parameters

• Formula: C23 H24 Cd N4 O9 S
• Calculated formula: C23 H23.68 Cd N4 O9 S
• Title of publication: Construction of two Zn(ii)/Cd(ii) multifunctional coordination polymers with mixed ligands for catalytic and sensing properties
• Authors of publication: Xue, Li-Ping; Li, Zhao-Hao; Zhang, Ting; Cui, Jia-Jia; Gao, Yue; Yao, Jia-Xin
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 17
• Pages of publication: 14203
• a: 9.7826 ± 0.0005 Å
• b: 20.2974 ± 0.0011 Å
• c: 13.2462 ± 0.0008 Å
• α: 90°
• β: 92.413 ± 0.005°
• γ: 90°
• Cell volume: 2627.9 ± 0.3 ų
• Cell temperature: 289.1 ± 0.2 K
• Ambient diffraction temperature: 289.1 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1214
• Residual factor for significantly intense reflections: 0.0828
• Weighted residual factors for significantly intense reflections: 0.2049
• Weighted residual factors for all reflections included in the refinement: 0.2172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.187
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No