Information card for entry 7227227

Structure parameters

• Formula: C47 H44 Cd Cl2 N8 O7 S2
• Calculated formula: C47 H44 Cd Cl2 N8 O7 S2
• Title of publication: Cadmium(II) complexes with 4-acyl pyrazolone derivative and co-ligands: crystal structure and antitumor activity
• Authors of publication: Luo, Hua-Ying; Li, Jin-Yu; Li, Yue; Zhang, Li; Li, Jin-Yao; jia, dianzeng; Xu, Guan-Cheng
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 28.215 ± 0.002 Å
• b: 9.7235 ± 0.0008 Å
• c: 17.3731 ± 0.0014 Å
• α: 90°
• β: 100.069 ± 0.001°
• γ: 90°
• Cell volume: 4692.9 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• 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: 0.0732
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.2191
• Weighted residual factors for all reflections included in the refinement: 0.2289
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No