Information card for entry 7034739

Structure parameters

• Formula: C23 H21 Cl2 Cu N3 O4
• Calculated formula: C23 H21 Cl2 Cu N3 O4
• SMILES: [Cu]12([n]3ccccc3C[N]1(Cc1[n]2cccc1)Cc1cccc2c1cccc2)Cl.Cl(=O)(=O)(=O)[O-]
• Title of publication: Synthesis, characterization, DNA/BSA interactions and anticancer activity of achiral and chiral copper complexes.
• Authors of publication: Zhou, Xue-Quan; Sun, Qian; Jiang, Lin; Li, Si-Tong; Gu, Wen; Tian, Jin-Lei; Liu, Xin; Yan, Shi-Ping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 20
• Pages of publication: 9516 - 9527
• a: 13.966 ± 0.004 Å
• b: 13.887 ± 0.004 Å
• c: 23.249 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4509 ± 2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0407
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No