Information card for entry 7702782

Structure parameters

• Formula: C36 H54 Cl2 Co2 N12 O15
• Calculated formula: C36 H40 Cl1.5 Co2 N12 O15
• Title of publication: Equilibrium and structural studies of complexes with a hexadentate ligand containing amide, amine and pyridyl nitrogen donors. Crystal structures of copper(ii), nickel(ii) and cobalt(iii) complexes
• Authors of publication: Jubert, Caroline; Mohamadou, Aminou; Gérard, Christian; Brandes, Stéphane; Tabard, Alain; Barbier, Jean-Pierre
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 13
• Pages of publication: 2660
• a: 11.6623 ± 0.0003 Å
• b: 13.0775 ± 0.0003 Å
• c: 16.7715 ± 0.0005 Å
• α: 75.898 ± 0.005°
• β: 71.629 ± 0.005°
• γ: 71.844 ± 0.005°
• Cell volume: 2276.46 ± 0.14 ų
• Cell temperature: 294 K
• Ambient diffraction temperature: 294 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.129
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for all reflections: 0.492
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections: 8.421
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No