Information card for entry 7710366

Structure parameters

• Common name: 3_200K
• Formula: C42.5 H33 Cl4 F6 N6 O2 Ru2
• Calculated formula: C42.5 H33 Cl4 F6 N6 O2 Ru2
• Title of publication: New insights in the progressive ligand replacement from [Ru2Cl(O2CCH3)4]: synthetic strategies and variation of redox potentials and paramagnetic shifts
• Authors of publication: Inchausti, Almudena; Terán, Aarón; Manchado-Parra, Alberto; de Marcos-Galán, Alessandra; Perles, Josefina; Cortijo, Miguel; González-Prieto, Rodrigo; HERRERO (DOMINGUEZ), SANTIAGO; Jimenez-Aparicio, Reyes
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 41.5237 ± 0.0013 Å
• b: 12.0831 ± 0.0004 Å
• c: 20.6065 ± 0.0005 Å
• α: 90°
• β: 114.251 ± 0.001°
• γ: 90°
• Cell volume: 9426.6 ± 0.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.08
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1769
• Weighted residual factors for all reflections included in the refinement: 0.1938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.164
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No