Information card for entry 7714646

Structure parameters

• Formula: C39 H34 Cl6 Cu N5 O8
• Calculated formula: C39 H34 Cl6 Cu N5 O8
• Title of publication: Chromophore appended DPA-based copper(II) complexes with a diimine motif towards DNA binding and fragmentation studies.
• Authors of publication: Mathur, Shobhit; Karumban, Kalai Selvan; Muley, Arabinda; Tuti, Nikhil; Shaji, Unnikrishnan Paruthiyezhath; Roy, Indrajit; Verma, Anushka; Kumawat, Manoj Kumar; Roy, Anindya; Maji, Somnath
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1163 - 1177
• a: 11.4847 ± 0.0004 Å
• b: 13.8486 ± 0.0005 Å
• c: 27.0798 ± 0.001 Å
• α: 90°
• β: 98.107 ± 0.001°
• γ: 90°
• Cell volume: 4263.9 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 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: 0.0978
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No