Information card for entry 4067327

Structure parameters

• Formula: C35 H35 Cl2 N3 O0.5 Ru
• Calculated formula: C35 H35 Cl2 N3 O0.5 Ru
• Title of publication: Latent Thermo-Switchable Olefin Metathesis Initiators Bearing a Pyridyl-Functionalized Chelating Carbene: Influence of the Leaving Group’s Rigidity on the Catalyst’s Performance
• Authors of publication: Szadkowska, Anna; Gstrein, Xaver; Burtscher, Daniel; Jarzembska, Katarzyna; Woźniak, Krzysztof; Slugovc, Christian; Grela, Karol
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 1
• Pages of publication: 117
• a: 33.7896 ± 0.0014 Å
• b: 33.7896 ± 0.0014 Å
• c: 11.2009 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12788.5 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.1199
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0985
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No