Information card for entry 7041553

Structure parameters

• Formula: C49 H44 F3 N8 O4 Ru2 S
• Calculated formula: C45 H36 F3 N8 O3 Ru2 S
• Title of publication: Anilinopyridinate-supported Ru2(x+) (x = 5 or 6) paddlewheel complexes with labile axial ligands.
• Authors of publication: Corcos, Amanda R.; Berry, John F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 5532 - 5539
• a: 13.6942 ± 0.0002 Å
• b: 13.6942 ± 0.0002 Å
• c: 24.9354 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4676.16 ± 0.12 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200.01 K
• Number of distinct elements: 7
• Space group number: 130
• Hermann-Mauguin space group symbol: P 4/n c c
• Hall space group symbol: -P 4a 2ac
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.1866
• Weighted residual factors for all reflections included in the refinement: 0.1977
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No