Information card for entry 7063979

Structure parameters

• Formula: C14 H12 Br Cl Cu N2 O
• Calculated formula: C14 H12 Br Cl Cu N2 O
• Title of publication: Biophysical characterization of centrosymmetric doubly bridged Cu(ii) complexes: comparative DNA/BSA binding and potential applications
• Authors of publication: Pattanayak, Satyajit; Sarkar, Tuhin; Maity, Ribhu; Das, Priyanka; Brandao, Paula; Maity, Tithi; Sarkar, Keka; Samanta, Bidhan Chandra
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• Journal volume: 49
• Journal issue: 38
• Pages of publication: 16849 - 16862
• a: 10.119 ± 0.002 Å
• b: 9.0203 ± 0.0017 Å
• c: 16.587 ± 0.004 Å
• α: 90°
• β: 95.181 ± 0.007°
• γ: 90°
• Cell volume: 1507.8 ± 0.5 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0292
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0675
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No