Information card for entry 7035200

Structure parameters

• Formula: C53 H75 Cl2 N2 P Ru
• Calculated formula: C53 H75 Cl2 N2 P Ru
• Title of publication: Ruthenium indenylidene complexes bearing N-alkyl/N-mesityl-substituted N-heterocyclic carbene ligands.
• Authors of publication: Yu, Baoyi; Hamad, Fatma B.; Sels, Bert; Van Hecke, Kristof; Verpoort, Francis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 26
• Pages of publication: 11835 - 11842
• a: 13.8813 ± 0.0006 Å
• b: 16.8687 ± 0.0007 Å
• c: 24.0954 ± 0.0007 Å
• α: 70.009 ± 0.003°
• β: 76.91 ± 0.003°
• γ: 70.625 ± 0.004°
• Cell volume: 4961.1 ± 0.4 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0959
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for significantly intense reflections: 0.1392
• Weighted residual factors for all reflections included in the refinement: 0.1674
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No