Information card for entry 7035407

Structure parameters

• Formula: C33 H31 Cl2 Cu N5 O8
• Calculated formula: C33 H31 Cl2 Cu N5 O8
• SMILES: [Cu]123([NH]2(CCC[N]3=Cc2c3ccccc3cc3ccccc23)C)([n]2cccc3ccc4ccc[n]1c4c23)[N]#CC.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: Fluorescent mixed ligand copper(ii) complexes of anthracene-appended Schiff bases: studies on DNA binding, nuclease activity and cytotoxicity.
• Authors of publication: Jaividhya, Paramasivam; Ganeshpandian, Mani; Dhivya, Rajkumar; Akbarsha, Mohammad Abdulkadher; Palaniandavar, Mallayan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 26
• Pages of publication: 11997 - 12010
• a: 11.362 ± 0.006 Å
• b: 23.93 ± 0.012 Å
• c: 12.192 ± 0.006 Å
• α: 90°
• β: 108.863 ± 0.009°
• γ: 90°
• Cell volume: 3137 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1332
• Residual factor for significantly intense reflections: 0.1014
• Weighted residual factors for significantly intense reflections: 0.2303
• Weighted residual factors for all reflections included in the refinement: 0.2492
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No