Information card for entry 4114588

Structure parameters

• Formula: C29 H47 F3 N2 O3 Ru2 S
• Calculated formula: C29 H47 F3 N2 O3 Ru2 S
• SMILES: [Ru]12345([N]6(C(C)C)[Ru]789%10%11([N]1(=[C]67C)C(C)C)[c]1([c]8([c]%11([c]%10([c]91C)C)C)C)C)(OS(=O)(=O)C(F)(F)F)[c]1([c]3([c]4([c]5([c]21C)C)C)C)C
• Title of publication: Novel Coordinatively Unsaturated Bimetallic Complexes, [(η5-C5Me5)Ru(μ2-iPrNC(Me)NiPr)Ru(η5-C5Me5)]+: A Bridging Amidinate Ligand Perpendicular to the Metal-Metal Axis Effectively Stabilizes the Highly Reactive Cationic Diruthenium Species
• Authors of publication: Hideo Kondo; Kouki Matsubara; Hideo Nagashima
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 534 - 535
• a: 10.6176 ± 0.0002 Å
• b: 15.9728 ± 0.0003 Å
• c: 19.0453 ± 0.0004 Å
• α: 90°
• β: 101.981 ± 0.0008°
• γ: 90°
• Cell volume: 3159.59 ± 0.11 ų
• Cell temperature: 223.2 K
• Ambient diffraction temperature: 223.2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0445
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0886
• Weighted residual factors for all reflections included in the refinement: 0.0991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No