Information card for entry 7710679

Structure parameters

• Formula: C26 H34 Br2 F6 Mo P Ru S2
• Calculated formula: C26 H34 Br2 F6 Mo P Ru S2
• SMILES: [Mo]1234567([Ru]89%10%11%12([Br]1)([S]2c1c([S]38)cccc1)[c]1([c]%10([c]9([c]%11([c]%121C)C)C)C)C)(Br)[c]1([c]6([c]4([c]7([c]51C)C)C)C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: A thiolate-bridged ruthenium–molybdenum complex featuring terminal nitrido and bridging amido ligands derived from the N–H and N–N bond cleavage of hydrazine
• Authors of publication: Li, Yahui; Su, Linan; Yang, Dawei; Di, Kai; Wang, Baomin; Qu, Jingping
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 28.2657 ± 0.0016 Å
• b: 8.3531 ± 0.0005 Å
• c: 27.0412 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6384.6 ± 0.6 ų
• Cell temperature: 230 ± 2 K
• Ambient diffraction temperature: 230.01 K
• Number of distinct elements: 8
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0463
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0932
• Weighted residual factors for all reflections included in the refinement: 0.0966
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No