Information card for entry 4067570

Structure parameters

• Formula: C29 H56 P4 Ru
• Calculated formula: C29 H56 P4 Ru
• SMILES: [Ru]12([P](CC[P]2(C)C)(C)C)(C)([P](C)(C)CC[P]1(C)C)C#Cc1cc(cc(c1)C(C)(C)C)C(C)(C)C
• Title of publication: Controlled Synthesis of Dinuclear Acetylide-Bridged Ruthenium Complexes
• Authors of publication: Field, Leslie D.; Magill, Alison M.; Shearer, Timothy K.; Colbran, Stephen B.; Lee, Sang T.; Dalgarno, Scott J.; Bhadbhade, Mohan M.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 4
• Pages of publication: 957
• a: 10.109 ± 0.002 Å
• b: 13.5 ± 0.003 Å
• c: 13.66 ± 0.003 Å
• α: 77.7 ± 0.03°
• β: 72.79 ± 0.03°
• γ: 68.84 ± 0.03°
• Cell volume: 1648.8 ± 0.7 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0956
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1266
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No