Information card for entry 4072468

Structure parameters

• Formula: C70 H79 Cl2 F6 P5 Ru2
• Calculated formula: C70 H79 Cl2 F6 P5 Ru2
• SMILES: [Ru]1234([P](CC)(CC)CC)([P](CC)(CC)CC)(=C=C(CC#C[Ru]5678([P](c9ccccc9)(c9ccccc9)c9ccccc9)([P](c9ccccc9)(c9ccccc9)c9ccccc9)[cH]9[cH]5[cH]6[cH]7[cH]89)c5ccccc5)[cH]5[cH]4[cH]3[cH]2[cH]15.[P](F)(F)(F)(F)(F)[F-].ClCCl
• Title of publication: Preparation of Dinuclear Vinylidene Complexes and Their New Deprotonation Reactions
• Authors of publication: Liu, Chung-Wei; Lin, Ying-Chih; Huang, Shou-Ling; Cheng,; Liu, Yi-Hung; Wang, Yu
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 14
• Pages of publication: 3431
• a: 15.3762 ± 0.0002 Å
• b: 13.8246 ± 0.0002 Å
• c: 32.2115 ± 0.0005 Å
• α: 90°
• β: 95.036 ± 0.0004°
• γ: 90°
• Cell volume: 6820.76 ± 0.17 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0734
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1679
• Weighted residual factors for all reflections included in the refinement: 0.1879
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No