Information card for entry 4074412

Structure parameters

• Formula: C33 H41 Cl2 N3 Ru
• Calculated formula: C33 H41 Cl2 N3 Ru
• Title of publication: Latent Olefin Metathesis Catalysts Featuring Chelating Alkylidenes
• Authors of publication: Hejl, Andrew; Day, Michael W.; Grubbs, Robert H.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 26
• Pages of publication: 6149
• a: 13.5715 ± 0.0004 Å
• b: 11.653 ± 0.0004 Å
• c: 20.2953 ± 0.0006 Å
• α: 90°
• β: 100.807 ± 0.001°
• γ: 90°
• Cell volume: 3152.75 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0974
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 1.358
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No