Information card for entry 7057248

Structure parameters

• Formula: C13 H24 Cl3 N2 O2 Ru S2
• Calculated formula: C13 H24 Cl3 N2 O2 Ru S2
• Title of publication: Ru(iii)‒TMSO complexes containing azole-based ligands: synthesis and cytotoxicity study
• Authors of publication: Meiklejohn, Victoria; Depan, Dilip; Boudreaux, Seth P.; Murru, Siva; Perkins, Richard S.; Fronczek, Frank. R.; Srivastava, Radhey S.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 9
• Pages of publication: 6858
• a: 8.5892 ± 0.0003 Å
• b: 9.0424 ± 0.0003 Å
• c: 13.8651 ± 0.0005 Å
• α: 100.203 ± 0.002°
• β: 101.533 ± 0.002°
• γ: 109.326 ± 0.002°
• Cell volume: 960.57 ± 0.06 ų
• Cell temperature: 90 ± 0.5 K
• Ambient diffraction temperature: 90 ± 0.5 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0671
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No