Information card for entry 7116591

Structure parameters

• Chemical name: Ru-G
• Formula: C45 H62 N4 O9 Ru
• Calculated formula: C45 H62 N4 O9 Ru
• SMILES: [Ru]12([O]=C(O1)CNC(=O)OC(C)(C)C)(OC(=O)CNC(=O)OC(C)(C)C)([O](c1c(C=2)cccc1)C(C)C)=C1N(CCN1c1c(C)cc(C)cc1C)c1c(cc(C)cc1C)C
• Title of publication: Amino acids as chiral anionic ligands for ruthenium based asymmetric olefin metathesis
• Authors of publication: Ivry, Elisa; Ben-Asuly, Amos; Goldberg, Israel; Lemcoff, N. Gabriel
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2015
• Journal volume: 51
• Journal issue: 18
• Pages of publication: 3870 - 3873
• a: 16.0973 ± 0.0018 Å
• b: 18.0969 ± 0.0019 Å
• c: 20.125 ± 0.002 Å
• α: 90.43 ± 0.005°
• β: 113.25 ± 0.005°
• γ: 99.817 ± 0.005°
• Cell volume: 5289.5 ± 1 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1283
• Residual factor for significantly intense reflections: 0.0851
• Weighted residual factors for significantly intense reflections: 0.2068
• Weighted residual factors for all reflections included in the refinement: 0.2245
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No