Information card for entry 7024766

Structure parameters

• Formula: C36 H36 Co N2 O2
• Calculated formula: C36 H36 Co N2 O2
• SMILES: C1(=CC(C)=[N](c2cc(cc(c2)C)C)[Co]2(O1)[N](=C(C=C(c1ccccc1)O2)C)c1cc(cc(c1)C)C)c1ccccc1
• Title of publication: Synthesis and characterisation of bis(beta-ketoaminato) complexes of cobalt(II).
• Authors of publication: Robson, Kiyoshi C. D.; Phillips, Cory D.; Patrick, Brian O.; McNeil, W. Stephen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 10
• Pages of publication: 2573 - 2578
• a: 13.717 ± 0.003 Å
• b: 17.402 ± 0.003 Å
• c: 13.486 ± 0.003 Å
• α: 90°
• β: 113.825 ± 0.01°
• γ: 90°
• Cell volume: 2944.8 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0474
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No