Information card for entry 7022764

Structure parameters

• Common name: Cu Complex
• Formula: C20 H22 Cl2 Cu N4 O2
• Calculated formula: C20 H22 Cl2 Cu N4 O2
• SMILES: CO.c1cccc2c1[n]1c(cc2)C=[N]2CCc3[n](c4ccccc4[nH]3)[Cu]12(Cl)Cl.O
• Title of publication: Copper(II) complexes with 2NO and 3N donor ligands: synthesis, structures and chemical nuclease and anticancer activities.
• Authors of publication: Rajarajeswari, Chandrasekaran; Loganathan, Rangasamy; Palaniandavar, Mallayan; Suresh, Eringathodi; Riyasdeen, Anvarbatcha; Akbarsha, Mohamad Abdulkadhar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 23
• Pages of publication: 8347 - 8363
• a: 10.3104 ± 0.0005 Å
• b: 17.1202 ± 0.0009 Å
• c: 11.9361 ± 0.0006 Å
• α: 90°
• β: 90.781 ± 0.003°
• γ: 90°
• Cell volume: 2106.72 ± 0.18 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.074
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0877
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No