Information card for entry 7045070

Structure parameters

• Formula: C42 H36 Cl6 F6 Ir N12 P Ru2
• Calculated formula: C42 H36 Cl6 F6 Ir N12 P Ru2
• Title of publication: Stepwise synthesis of the heterotrimetallic chains [MRu₂(dpa)₄X₂]^0/1+ using group 7 to group 12 transition metal ions and [Ru₂(dpa)₄Cl].
• Authors of publication: Cheng, Ming-Chuan; Hua, Shao-An; Lv, Qiying; Sigrist, Marc; Lee, Gene-Hsiang; Liu, Yu-Chiao; Chiang, Ming-Hsi; Peng, Shie-Ming
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 5
• Pages of publication: 1422 - 1434
• a: 11.4236 ± 0.0003 Å
• b: 21.3206 ± 0.0006 Å
• c: 20.5318 ± 0.0006 Å
• α: 90°
• β: 92.958 ± 0.0009°
• γ: 90°
• Cell volume: 4994 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• 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: 0.0459
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for significantly intense reflections: 0.0844
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No