Information card for entry 4064083

Structure parameters

• Formula: C30 H40 Cl2 F3 N O3 Ru2 S
• Calculated formula: C30 H40 Cl2 F3 N O3 Ru2 S
• SMILES: [Ru]123456([Ru]789%10(N1c1ccccc1)(=[C]=2C)[c]1([c]7([c]8([c]9([c]%101C)C)C)C)C)[c]1([c]3([c]4([c]5([c]61C)C)C)C)C.ClCCl.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Synthesis and Reactivity of Coordinatively Unsaturated Dinuclear Ruthenium Bridging Imido Complexes
• Authors of publication: Takemoto, Shin; Kobayashi, Tomoharu; Ito, Takahiro; Inui, Akira; Karitani, Kenji; Katagiri, Sayuri; Masuhara, Yusaku; Matsuzaka, Hiroyuki
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 8
• Pages of publication: 2160
• a: 11.917 ± 0.003 Å
• b: 24.975 ± 0.008 Å
• c: 12.05 ± 0.003 Å
• α: 90°
• β: 107.903 ± 0.01°
• γ: 90°
• Cell volume: 3412.7 ± 1.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1403
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.1165
• Weighted residual factors for all reflections included in the refinement: 0.1486
• Goodness-of-fit parameter for all reflections included in the refinement: 0.962
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No