Information card for entry 4108190

Structure parameters

• Formula: C20 H26 B2 Cl2 F4 N8 O3 Ru
• Calculated formula: C20 H24 B2 Cl2 F4 N8 O3 Ru
• SMILES: [Ru]1234([O](C(OC)(C(OC)=[NH]1)c1[n]4cccc1)C)[n]1n(ccc1)[BH](n1[n]2ccc1)n1[n]3ccc1.ClCCl.[B](F)(F)(F)[F-]
• 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: 9.923 ± 0.004 Å
• b: 12.622 ± 0.005 Å
• c: 13.472 ± 0.005 Å
• α: 69.01 ± 0.02°
• β: 70.12 ± 0.02°
• γ: 66.72 ± 0.02°
• Cell volume: 1407.8 ± 1 ų
• Cell temperature: 296.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for all reflections included in the refinement: 0.1533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No