Information card for entry 7026603

Structure parameters

• Formula: C22 H36 Co F2 N P3
• Calculated formula: C22 H36 Co F2 N P3
• SMILES: N1([Co]([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)C1c1c(cccc1F)F)c1ccccc1
• Title of publication: Imine-assisted C-F bond activation using low-valent cobalt compounds supported by trimethylphosphine ligands and formation of novel organic fluorides.
• Authors of publication: Lian, Zhe; Xu, Xiaofeng; Sun, Hongjian; Chen, Yue; Zheng, Tingting; Li, Xiaoyan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 40
• Pages of publication: 9523 - 9529
• a: 8.513 ± 0.0017 Å
• b: 16.009 ± 0.003 Å
• c: 18.999 ± 0.004 Å
• α: 90°
• β: 94.35 ± 0.03°
• γ: 90°
• Cell volume: 2581.8 ± 0.9 ų
• Cell temperature: 423 ± 2 K
• Ambient diffraction temperature: 423 ± 2 K
• Number of distinct elements: 6
• 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: 0.0941
• Residual factor for significantly intense reflections: 0.0697
• Weighted residual factors for significantly intense reflections: 0.1781
• Weighted residual factors for all reflections included in the refinement: 0.1897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.169
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No