Information card for entry 1565688

Structure parameters

• Formula: C30 H28 Cl2 Cu2 N6 O12
• Calculated formula: C30 H28 Cl2 Cu2 N6 O12
• SMILES: c1(ccccc1)C1N[N]2=Cc3cc(ccc3[O]3[Cu]2([O]=1)([O]1c2c(C=[N]4[Cu]31([O]=C(N4)c1ccccc1)[OH]C)cc(cc2)Cl)[OH]C)Cl.O=N(=O)[O-].N(=O)(=O)[O-]
• Title of publication: Binuclear Schiff base copper(II) complexes: Syntheses, crystal structures, HSA interaction and anti-cancer properties
• Authors of publication: Jiang, Shengshi; Ni, Honghui; Liu, Fen; Gu, Shanshan; Yu, Ping; Gou, Yi
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 499
• Pages of publication: 119186
• a: 7.4839 ± 0.0013 Å
• b: 10.6238 ± 0.0018 Å
• c: 11.0673 ± 0.0019 Å
• α: 102.591 ± 0.003°
• β: 95.889 ± 0.002°
• γ: 98.472 ± 0.002°
• Cell volume: 841.1 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.0353
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.0845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No