Information card for entry 7236244

Structure parameters

• Formula: C28 H30 Cl4 Cu2 N6 O12
• Calculated formula: C28 H30 Cl4 Cu2 N6 O12
• Title of publication: Catecholase activity, DNA binding and cytotoxicity studies of a Cu(ii) complex of a pyridoxal schiff base: synthesis, X-ray crystal structure, spectroscopic, electrochemical and theoretical studies
• Authors of publication: Adak, Piyali; Ghosh, Bipinbihari; Bauzá, Antonio; Frontera, Antonio; Blake, Alexander J.; Corbella, Montserrat; Das Mukhopadhyay, Chitrangada; Chattopadhyay, Shyamal Kumar
• Journal of publication: RSC Advances
• Year of publication: 2016
• Journal volume: 6
• Journal issue: 90
• Pages of publication: 86851
• a: 7.7545 ± 0.0013 Å
• b: 8.7537 ± 0.0013 Å
• c: 13.97 ± 0.0011 Å
• α: 75.507 ± 0.01°
• β: 83.103 ± 0.01°
• γ: 65.615 ± 0.015°
• Cell volume: 836.1 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.061
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.154
• Weighted residual factors for all reflections included in the refinement: 0.159
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No