Information card for entry 7712807

Structure parameters

• Formula: C39 H63 Cl3 Co N4 P Si3
• Calculated formula: C39 H63 Cl3 Co N4 P Si3
• SMILES: [CoH]([Si]1(Cl)[N](C(C)(C)C)=C(N1C(C)(C)C)c1ccccc1)(Cl)([Si]1(Cl)[N](=C(N1C(C)(C)C)c1ccccc1)C(C)(C)C)([SiH2]c1ccccc1)[P](C)(C)C
• Title of publication: Effects of silylene ligands on performance of carbonyl hydrosilylation catalyzed by cobalt phosphine complexes
• Authors of publication: Fan, Qingqing; Du, Xinyu; Yang, Wenjing; Li, Qingshuang; Huang, Wei; Sun, Hongjian; Hinz, Alexander; Li, Xiaoyan
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 15.27681 ± 0.00017 Å
• b: 19.2189 ± 0.0003 Å
• c: 15.42856 ± 0.00019 Å
• α: 90°
• β: 95.7072 ± 0.0011°
• γ: 90°
• Cell volume: 4507.42 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0548
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1079
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No