Information card for entry 7700855

Structure parameters

• Formula: C51 H47 Cl7 N2 O2 P2 Ru
• Calculated formula: C51 H47 Cl7 N2 O2 P2 Ru
• Title of publication: Unusual C-O bond cleavage of aromatic ethers in ruthenium complexes bearing a 2-alkoxypyridyl fragment.
• Authors of publication: Deng, Danfeng; Hu, Bowen; Yang, Min; Chen, Dafa
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 36
• Pages of publication: 13614 - 13621
• a: 13.5226 ± 0.0007 Å
• b: 14.602 ± 0.0007 Å
• c: 14.9635 ± 0.0006 Å
• α: 95.196 ± 0.001°
• β: 115.07 ± 0.001°
• γ: 104.09 ± 0.002°
• Cell volume: 2531.9 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0624
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1107
• Weighted residual factors for all reflections included in the refinement: 0.1199
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No