Information card for entry 7005917

Structure parameters

• Formula: C20 H24 Cl2 Co N O2 P
• Calculated formula: C20 H24 Cl2 Co N O2 P
• SMILES: [Co]1(Cl)(Cl)[P](OC(C2OCC([N]1=2)(C)C)(C)C)(c1ccccc1)c1ccccc1
• Title of publication: Mono- and dinuclear cobalt complexes with chelating or bridging bidentate P,N phosphino- and phosphinito-oxazoline ligands: synthesis, structures and catalytic ethylene oligomerisation.
• Authors of publication: Jie, Suyun; Agostinho, Magno; Kermagoret, Anthony; Cazin, Catherine S. J.; Braunstein, Pierre
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 39
• Pages of publication: 4472 - 4482
• a: 8.997 ± 0.0002 Å
• b: 14.514 ± 0.0004 Å
• c: 16.788 ± 0.0004 Å
• α: 90°
• β: 93.215 ± 0.0015°
• γ: 90°
• Cell volume: 2188.77 ± 0.09 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0881
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No