Information card for entry 7721179

Structure parameters

• Chemical name: SNM_KK_ANTPYCuBpypy
• Formula: C42 H28 Cl2 Cu N6 O8
• Calculated formula: C42 H28 Cl2 Cu N6 O8
• Title of publication: Electronic Effects of 4/-Aryl Substitution in Terpyridine Copper(II) Complexes: Structural Insights, DNA-Binding Affinity, and Cytotoxic Evaluation
• Authors of publication: Karthikeyan, L.; Mathur, Shobhit; Shahnaz, Nafeesa; Patra, Snehashish; Roy, Anindya; Maji, Somnath
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 11.1215 ± 0.0011 Å
• b: 13.3263 ± 0.0015 Å
• c: 13.6349 ± 0.0015 Å
• α: 96.387 ± 0.004°
• β: 100.342 ± 0.004°
• γ: 93.06 ± 0.004°
• Cell volume: 1970.1 ± 0.4 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.0742
• Residual factor for significantly intense reflections: 0.0566
• Weighted residual factors for significantly intense reflections: 0.1655
• Weighted residual factors for all reflections included in the refinement: 0.1791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No