Information card for entry 4067233

Structure parameters

• Formula: C36 H38 F12 N8 O P2 Ru
• Calculated formula: C36 H38 F12 N8 O P2 Ru
• Title of publication: [Ru(bpy)3]2+Analogues Containing an N-Heterocyclic Carbene Ligand
• Authors of publication: Ghattas, Wadih; Müller-Bunz, Helge; Albrecht, Martin
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 24
• Pages of publication: 6782
• a: 14.6848 ± 0.0013 Å
• b: 13.145 ± 0.0009 Å
• c: 20.0896 ± 0.0016 Å
• α: 90°
• β: 93.954 ± 0.007°
• γ: 90°
• Cell volume: 3868.7 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0606
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0494
• Weighted residual factors for all reflections included in the refinement: 0.0522
• Goodness-of-fit parameter for all reflections included in the refinement: 0.731
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No