Information card for entry 4303881

Structure parameters

• Formula: C44 H36 Cl2 P2 Ru S2
• Calculated formula: C44 H36 Cl2 P2 Ru S2
• Title of publication: Efficient Transfer of Either One or Two Dithiolene Ligands from Nickel to Ruthenium: Synthesis and Crystal Structures of [Ru(SCR=CPhS)2(PPh3)] and [RuCl2(SCR=CPhS)(PPh3)2] (R = Ph, H)
• Authors of publication: Harry Adams; Anna M. Coffey; Michael J. Morris; Sarah A. Morris
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 11945 - 11953
• a: 10.1008 ± 0.0004 Å
• b: 36.5535 ± 0.0016 Å
• c: 12.2298 ± 0.0005 Å
• α: 90°
• β: 107.62 ± 0.002°
• γ: 90°
• Cell volume: 4303.6 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.075
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.1325
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No