Information card for entry 7707428

Structure parameters

• Chemical name: tris-(4,4'-dimethyl-2,2'-bipyridine )- rutenium(II) bis(trifluoromethanesulfonate) dihydrate'
• Formula: C38 H40 F6 N6 O8 Ru S2
• Calculated formula: C38 H40 F6 N6 O8 Ru S2
• Title of publication: Half-sandwich organometallic Ru and Rh complexes of (N,N) donor compounds: effect of ligand methylation on solution speciation and anticancer activity.
• Authors of publication: Mészáros, János P; Pape, Veronika F. S.; Szakács, Gergely; Németi, Gábor; Dénes, Márk; Holczbauer, Tamás; May, Nóra V; Enyedy, Éva A
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 23
• Pages of publication: 8218 - 8231
• a: 13.1264 ± 0.001 Å
• b: 19.0317 ± 0.0011 Å
• c: 17.1384 ± 0.001 Å
• α: 90°
• β: 96.644 ± 0.007°
• γ: 90°
• Cell volume: 4252.7 ± 0.5 ų
• Cell temperature: 126 ± 2 K
• Ambient diffraction temperature: 126 ± 2 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: 0.1485
• Residual factor for significantly intense reflections: 0.096
• Weighted residual factors for significantly intense reflections: 0.1987
• Weighted residual factors for all reflections included in the refinement: 0.2322
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No