Information card for entry 4303648

Structure parameters

• Formula: C28 H33.65 N6 O7.83 Zn
• Calculated formula: C28 H33.652 N6 O7.826 Zn
• Title of publication: Selective Chelation of Cd(II) and Pb(II) versus Ca(II) and Zn(II) by Using Octadentate Ligands Containing Pyridinecarboxylate and Pyridyl Pendants
• Authors of publication: Raquel Ferreirós-Martínez; David Esteban-Gómez; Carlos Platas-Iglesias; Andrés de Blas; Teresa Rodríguez-Blas
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 10976 - 10987
• a: 10.791 ± 0.0006 Å
• b: 11.8384 ± 0.0007 Å
• c: 12.6031 ± 0.0007 Å
• α: 103.007 ± 0.001°
• β: 94.263 ± 0.001°
• γ: 109.66 ± 0.001°
• Cell volume: 1457.38 ± 0.14 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0371
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No