Information card for entry 1516897

Structure parameters

• Common name: [Cu(L)Cl](ClO4)(H2O)
• Formula: C19 H22 Cl2 Cu N4 O5
• Calculated formula: C19 H22 Cl2 Cu N4 O5
• Title of publication: Effect of the chelate ring size on the cleavage activity of DNA by copper(II) complexes containing pyridyl groups
• Authors of publication: Salah S. Massoud; Richard S. Perkins; Kathleen D. Knierim; Sean P. Comiskey; Kara H. Otero; Corey L. Michel; Wesley M. Juneau; Jorg H. Albering; Franz A. Mautner; Wu Xu
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 399
• Pages of publication: 177 - 184
• a: 12.406 ± 0.0003 Å
• b: 15.4849 ± 0.0004 Å
• c: 23.3147 ± 0.0005 Å
• α: 72.584 ± 0.001°
• β: 89.659 ± 0.001°
• γ: 85.182 ± 0.001°
• Cell volume: 4257.59 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0446
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0804
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No