Information card for entry 7119448

Structure parameters

• Formula: C24 H32 F12 N6 P2 Ru
• Calculated formula: C24 H32 F12 N6 P2 Ru
• SMILES: c12cccc[n]2[Ru]23([n]4c(C[N]53[C@@H]([C@@H]3[N]2(C1)CCC3)CCC5)cccc4)([N]#CC)[N]#CC.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: The stereoselectivity of bipyrrolidine-based sequential polydentate ligands around Ru(II)
• Authors of publication: Yanay; Popowski; Israel; Goldberg; Moshe; Kol
• Journal of publication: Chem.Commun.
• Year of publication: 2016
• Journal volume: 52
• Pages of publication: 7932
• a: 10.2422 ± 0.0002 Å
• b: 10.2422 ± 0.0002 Å
• c: 24.9887 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2270.18 ± 0.08 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.0199
• Residual factor for significantly intense reflections: 0.0196
• Weighted residual factors for significantly intense reflections: 0.0474
• Weighted residual factors for all reflections included in the refinement: 0.0476
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No