Information card for entry 4064087

Structure parameters

• Formula: C46 H71 N5 Ru2
• Calculated formula: C46 H71 N5 Ru2
• SMILES: [Ru]12345([N](=CN1C(C)(C)C)c1c([Ru]6789(C#[N]C(C)(C)C)(C#[N]C(C)(C)C)[c]%10([c]9([c]8([c]7([c]6%10C)C)C)C)C)cccc1)(C#[N]C(C)(C)C)[c]1([c]3([c]4([c]5([c]21C)C)C)C)C
• 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: 13.59 ± 0.004 Å
• b: 20.82 ± 0.004 Å
• c: 16.966 ± 0.004 Å
• α: 90°
• β: 91.196 ± 0.011°
• γ: 90°
• Cell volume: 4799 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.0874
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.1126
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No