Information card for entry 7059574

Structure parameters

• Formula: C38 H44 Cd2 N8 O10
• Calculated formula: C38 H44 Cd2 N8 O10
• Title of publication: Cd(ii) coordination compounds as heterogeneous catalysts for microwave-assisted peroxidative oxidation of toluene and 1-phenylethanol
• Authors of publication: Sutradhar, Manas; Roy Barman, Tannistha; Alegria, Elisabete C. B. A.; Lapa, Hugo M.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 22
• Pages of publication: 9163 - 9171
• a: 12.732 ± 0.002 Å
• b: 12.938 ± 0.002 Å
• c: 13.914 ± 0.002 Å
• α: 90°
• β: 113.651 ± 0.006°
• γ: 90°
• Cell volume: 2099.5 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0277
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0494
• Weighted residual factors for all reflections included in the refinement: 0.0533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No