Information card for entry 4128266

Structure parameters

• Formula: C50 H52 Cl4 N4 O2 Ru
• Calculated formula: C50 H52 Cl4 N4 O2 Ru
• Title of publication: Living Polymerization Caught in the Act: Direct Observation of an Arrested Intermediate in Metathesis Polymerization.
• Authors of publication: Song, Jung-Ah; Park, Bohyun; Kim, Soohyung; Kang, Cheol; Lee, Dongwhan; Baik, Mu-Hyun; Grubbs, Robert H.; Choi, Tae-Lim
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 25
• Pages of publication: 10039 - 10047
• a: 9.9196 ± 0.0001 Å
• b: 21.8678 ± 0.0001 Å
• c: 21.5084 ± 0.0001 Å
• α: 90°
• β: 100.817 ± 0.001°
• γ: 90°
• Cell volume: 4582.7 ± 0.06 ų
• Cell temperature: 101 ± 2 K
• Ambient diffraction temperature: 101 ± 2 K
• Number of distinct elements: 6
• 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: 0.0225
• Residual factor for significantly intense reflections: 0.0223
• Weighted residual factors for significantly intense reflections: 0.0532
• Weighted residual factors for all reflections included in the refinement: 0.0533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No