Information card for entry 4108188

Structure parameters

• Formula: C17 H18 B Cl N8 O Ru
• Calculated formula: C17 H18 B Cl N8 O Ru
• SMILES: [Ru]123(Cl)([N](=O)C=Cc4[n]3cc(cc4)C)[n]3n(ccc3)[BH](n3[n]1ccc3)n1[n]2ccc1
• Title of publication: N-C Bond Formation of NO Ligands on Ruthenium Complexes with Concurrent Vinylic C-H Activation and Subsequent Proton-Induced Reactivities of the Resulting Nitrosovinyl Species
• Authors of publication: Yasuhiro Arikawa; Taiki Asayama; Kazuki Itatani; Masayoshi Onishi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 10508 - 10509
• a: 10.1937 ± 0.0017 Å
• b: 14.149 ± 0.002 Å
• c: 13.872 ± 0.002 Å
• α: 90°
• β: 101.328 ± 0.002°
• γ: 90°
• Cell volume: 1961.8 ± 0.5 ų
• Cell temperature: 123.1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No