Information card for entry 7043166

Structure parameters

• Formula: C49 H53 Cl2 Co F3 N3 O3.25 P3 Ru S
• Calculated formula: C49 H51 Cl2 Co F3 N3 O3.25 P3 Ru S
• Title of publication: Enhancement of the antiproliferative activity of [RuCp(PPh3)2(dmoPTA-1κP)]+ via its coordination to one {CoCl2} unit: synthesis, crystal structure and properties of [RuCp(PPh3)2-μ-dmoPTA-1κP:2κ2N,N’-CoCl2](OTf)·0.25H2O.
• Authors of publication: Mendoza, Zenaida; Lorenzo-Luis, Pablo; Scalambra, Franco; Padrón, José M.; Romerosa, Antonio
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 11.1351 ± 0.0008 Å
• b: 20.8269 ± 0.0015 Å
• c: 22.1074 ± 0.0016 Å
• α: 106.301 ± 0.001°
• β: 93.324 ± 0.001°
• γ: 94.3 ± 0.001°
• Cell volume: 4890.2 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1004
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No