Information card for entry 7061498

Structure parameters

• Formula: C17 H19 Cl2 F N2 Ru S
• Calculated formula: C17 H19 Cl2 F N2 Ru S
• Title of publication: Synthesis, structural insights, and biological screening of DNA targeted Ru(ii)(η6-p-cymene) complexes containing bioactive amino-benzothiazole ligand scaffolds
• Authors of publication: Akhter, Suffora; Rehman, Abdur; Abidi, S. M. A.; Arjmand, Farukh; Tabassum, Sartaj
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 23
• Pages of publication: 11462 - 11473
• a: 13.497 ± 0.0003 Å
• b: 7.3836 ± 0.0002 Å
• c: 21.9509 ± 0.0006 Å
• α: 90°
• β: 105.312 ± 0.002°
• γ: 90°
• Cell volume: 2109.9 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.061
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No