Information card for entry 7061739

Structure parameters

• Formula: C51 H41 Cl Cu N7 O9
• Calculated formula: C51 H41 Cl Cu N7 O9
• SMILES: [Cu]12([n]3c4ccccc4ccc3C=[N]1CCN1C(=O)c3cccc4cccc(C1=O)c34)[n]1c3ccccc3ccc1C=[N]2CCN1C(=O)c2cccc3cccc(C1=O)c23.Cl(=O)(=O)(=O)[O-].O=CN(C)C
• Title of publication: Copper(i) complexes with quinolone appended 1,8-naphthalimide conjugates: structural characterization, DNA and protein binding and cytotoxicity studies
• Authors of publication: Shaikh, Sabiha A.; Bhat, Satish S.; Revankar, Vidyanand K.; S., Naveen; Kumara, Karthik; Lokanath, N. K.; Butcher, Ray J.; Kumbar, Vijay; Bhat, Kishore
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 35
• Pages of publication: 16801 - 16812
• a: 14.118 ± 0.005 Å
• b: 23.545 ± 0.005 Å
• c: 14.614 ± 0.004 Å
• α: 90°
• β: 114.641 ± 0.011°
• γ: 90°
• Cell volume: 4415 ± 2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.1065
• Residual factor for significantly intense reflections: 0.0708
• Weighted residual factors for significantly intense reflections: 0.1616
• Weighted residual factors for all reflections included in the refinement: 0.1913
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No