Information card for entry 7062675

Structure parameters

• Formula: C53 H40 N2 O2 P2 Ru
• Calculated formula: C53 H40 N2 O2 P2 Ru
• Title of publication: Synthesis of Ru(ii) cyclometallated complexes via C(aryl)–S bond activation: X-ray structure, DNA/BSA protein binding and antiproliferative activity
• Authors of publication: Das, Akash; Mandal, Subrata; Mukherjee, Rimi; Naskar, Rahul; Murmu, Nabendu; Mondal, Tapan K.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 37
• Pages of publication: 17359 - 17372
• a: 18.2738 ± 0.0015 Å
• b: 15.3551 ± 0.0011 Å
• c: 9.8021 ± 0.0007 Å
• α: 90°
• β: 120.739 ± 0.002°
• γ: 90°
• Cell volume: 2364 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 8
• Hermann-Mauguin space group symbol: C 1 m 1
• Hall space group symbol: C -2y
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections included in the refinement: 0.0666
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No