Information card for entry 4083113

Structure parameters

• Formula: C52 H65 Cl2 N2 P Ru
• Calculated formula: C52 H65 Cl2 N2 P Ru
• Title of publication: Synthesis, Structure, and Catalytic Activity of New Ruthenium(II) Indenylidene Complexes Bearing Unsymmetrical N-Heterocyclic Carbenes
• Authors of publication: Ablialimov, Osman; Kędziorek, Mariusz; Malińska, Maura; Woźniak, Krzysztof; Grela, Karol
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 9
• Pages of publication: 2160
• a: 15.9155 ± 0.0004 Å
• b: 14.4122 ± 0.0004 Å
• c: 22.8409 ± 0.0006 Å
• α: 90°
• β: 102.7 ± 0.003°
• γ: 90°
• Cell volume: 5111 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0804
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.1632
• Weighted residual factors for all reflections included in the refinement: 0.1758
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No