Information card for entry 4322918

Structure parameters

• Formula: C33 H57 Li O2.5 P Ru S4
• Calculated formula: C33 H52 Li O2.5 P Ru S4
• Title of publication: Transition Metal Complexes with Sulfur Ligands. 130.1 Synthesis, Structure, and Reactivity of the Sulfur-Rich Ruthenium Hydride Complexes [Ru(H)(PR~3~)('S~4~')]^-^ and the η2-H2 Complex [Ru(H~2~)(PCy~3~)('S~4~')] (R = Ph, ^i^Pr, Cy; 'S~4~'2- = 1,2-Bis((2-mercaptophenyl)thio)ethane(2-))
• Authors of publication: Dieter Sellmann; Torsten Gottschalk-Gaudig; Frank W. Heinemann
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 3982 - 3988
• a: 14.016 ± 0.002 Å
• b: 10.452 ± 0.003 Å
• c: 25.906 ± 0.004 Å
• α: 90°
• β: 95.04 ± 0.01°
• γ: 90°
• Cell volume: 3780.4 ± 1.3 ų
• Cell temperature: 175 ± 2 K
• Ambient diffraction temperature: 175 ± 2 K
• Number of distinct elements: 7
• 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: 0.0452
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for all reflections: 0.0906
• Weighted residual factors for significantly intense reflections: 0.0713
• Goodness-of-fit parameter for all reflections: 0.925
• Goodness-of-fit parameter for significantly intense reflections: 0.873
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No