Information card for entry 1512711

Structure parameters

• Formula: C27 H31 F6 N4 O3 P Ru
• Calculated formula: C27 H30 F6 N4 O3 P Ru
• SMILES: [Ru]123([O]=C(O1)C)([n]1c(cccc1c1[n]2c(ccc1)C)C)[n]1c(cccc1c1[n]3c(ccc1)C)C.[P](F)(F)(F)(F)(F)[F-].OC
• Title of publication: Sterically-directed disassembly of diruthenium(II,III) tetraacetate using substituted and unsubstituted 2,2'-bipyridines and 1,10-phenanthrolines
• Authors of publication: Luc J. Boudreau; Terri L. Clarke; Adrian H. Murray; Katherine N. Robertson; T. Stanley Cameron; Manuel A.S. Aquino
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 393
• Pages of publication: 152 - 158
• a: 14.5527 ± 0.0018 Å
• b: 14.5492 ± 0.0016 Å
• c: 15.2941 ± 0.0019 Å
• α: 90°
• β: 118.38 ± 0.0012°
• γ: 90°
• Cell volume: 2849 ± 0.6 ų
• Cell temperature: 113.1 K
• Ambient diffraction temperature: 113.1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for all reflections included in the refinement: 0.0666
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No