Information card for entry 4318093

Structure parameters

• Formula: C30 H27 Cl0 F3 O7 P2 Ru S
• Calculated formula: C30 H25 F3 O7 P2 Ru S
• Title of publication: Substitution Reactions of [Ru(dppe)(CO)(H2O)3][OTf]2
• Authors of publication: Matthew D. Hargreaves; Mary F. Mahon; Michael K. Whittlesey
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 3137 - 3145
• a: 24.035 ± 0.0014 Å
• b: 20.841 ± 0.0017 Å
• c: 14.38 ± 0.002 Å
• α: 90 ± 0.006°
• β: 97.267 ± 0.005°
• γ: 90 ± 0.004°
• Cell volume: 7145.3 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.3647
• Residual factor for significantly intense reflections: 0.1512
• Weighted residual factors for significantly intense reflections: 0.3009
• Weighted residual factors for all reflections included in the refinement: 0.3708
• Goodness-of-fit parameter for all reflections included in the refinement: 1.314
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No