Information card for entry 4306983

Structure parameters

• Formula: C66 H52 Cl6 Cu3 N24 O2
• Calculated formula: C66 H52.002 Cl6 Cu3 N24 O2.001
• Title of publication: A Trinuclear Copper(II) Complex of 2,4,6-Tris(di-2-pyridylamine)-1,3,5-triazine Shows Prominent DNA Cleavage Activity
• Authors of publication: Jingwen Chen; Xiaoyong Wang; Ying Shao; Jianhui Zhu; Yangguang Zhu; Yizhi Li; Qiang Xu; Zijian Guo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 3306 - 3312
• a: 12.852 ± 0.002 Å
• b: 13.046 ± 0.002 Å
• c: 13.196 ± 0.003 Å
• α: 65.167 ± 0.004°
• β: 76.711 ± 0.005°
• γ: 79.219 ± 0.005°
• Cell volume: 1943.9 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0652
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1267
• Weighted residual factors for all reflections included in the refinement: 0.1299
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No