Information card for entry 1507916

Structure parameters

• Formula: C41 H46 Cl2 Cu2 N6 O15
• Calculated formula: C41 H46 Cl2 Cu2 N6 O15
• Title of publication: Synthesis, crystal structure, DNA-binding properties, cytotoxic and antioxidation activities of several ternary copper(II) complexes with a new reduced Schiff base ligand
• Authors of publication: Jiaa, Lei; Shib, Jie; Sunb, Zhi-hong; Lia, Fei-fei; Wanga, Yuan; Wua, Wei-na; Wang, Qin
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 391
• Pages of publication: 121 - 129
• a: 10.5259 ± 0.0006 Å
• b: 18.6643 ± 0.001 Å
• c: 11.6372 ± 0.0007 Å
• α: 90°
• β: 95.763 ± 0.001°
• γ: 90°
• Cell volume: 2274.7 ± 0.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0641
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1421
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No