Information card for entry 7012644

Structure parameters

• Common name: (Ru(1,4-tppb)2)(PF6)2
• Formula: C60 H56 F12 N12 P2 Ru
• Calculated formula: C60 H56 F12 N12 P2 Ru
• SMILES: c1([N]23[Ru]45([n]6ccccc6C2)([n]2ccccc2C3)[N](c2ccc(cc2)N(Cc2ccccn2)Cc2ccccn2)(Cc2cccc[n]42)Cc2cccc[n]52)ccc(cc1)N(Cc1ccccn1)Cc1ccccn1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Stepwise construction of mono-, di- and tri-nuclear 2 ? 1, 1 ? 2, 2 ? 3 ligand ? mixed-metal complexes using a bis-tridentate bridging ligand
• Authors of publication: Hazell, Alan; Hazell, Rita; McKenzie, Christine J.; Nielsen, Lars Preuss
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 11
• Pages of publication: 2203
• a: 25.578 ± 0.001 Å
• b: 27.03 ± 0.001 Å
• c: 35.028 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 24217.4 ± 1.9 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 6
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d :2
• Hall space group symbol: -F 2uv 2vw
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for all reflections included in the refinement: 0.058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.213
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No