Information card for entry 4120088

Structure parameters

• Formula: C32 H46 N2 O3 Ru
• Calculated formula: C32 H46 N2 O3 Ru
• Title of publication: Synthesis of Highly Cis, Syndiotactic Polymers via Ring-Opening Metathesis Polymerization Using Ruthenium Metathesis Catalysts
• Authors of publication: Lauren E. Rosebrugh; Vanessa M. Marx; Benjamin K. Keitz; Robert H. Grubbs
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 10032 - 10035
• a: 11.0782 ± 0.0005 Å
• b: 27.9893 ± 0.0011 Å
• c: 10.2073 ± 0.0004 Å
• α: 90°
• β: 103.793 ± 0.002°
• γ: 90°
• Cell volume: 3073.7 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• 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: 0.0645
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.468
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes