Information card for entry 7064169

Structure parameters

• Formula: C21 H27 N3 O6 Ru
• Calculated formula: C21 H27 N3 O6 Ru
• Title of publication: Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands
• Authors of publication: Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter
• Journal of publication: New Journal of Chemistry
• Year of publication: 2026
• a: 9.4175 ± 0.0003 Å
• b: 10.0566 ± 0.0004 Å
• c: 12.3547 ± 0.0005 Å
• α: 78.091 ± 0.003°
• β: 85.705 ± 0.003°
• γ: 72.853 ± 0.003°
• Cell volume: 1093.89 ± 0.07 ų
• Cell temperature: 150 ± 0.02 K
• Ambient diffraction temperature: 150 ± 0.02 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0619
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1524
• Weighted residual factors for all reflections included in the refinement: 0.1557
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No