Information card for entry 7710428

Structure parameters

• Formula: C50 H53 Cl2 Co P2 Ru S3
• Calculated formula: C50 H53 Cl2 Co P2 Ru S3
• Title of publication: Reversible Binding of Dinitrogen on a Thiolate-Bridged Cobalt-Ruthenium Complex Supported by a Flexible Bidentate Phosphine Ligand
• Authors of publication: Dong, Wenjing; Yang, Dawei; Mei, Tao; Wang, Baomin; Qu, Jingping
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 13.0207 ± 0.0007 Å
• b: 24.9378 ± 0.0013 Å
• c: 14.6486 ± 0.0007 Å
• α: 90°
• β: 104.173 ± 0.001°
• γ: 90°
• Cell volume: 4611.7 ± 0.4 ų
• Cell temperature: 220 K
• Ambient diffraction temperature: 220 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0409
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No