Information card for entry 7236012

Structure parameters

• Formula: C27 H28 Cu N4 O7 S
• Calculated formula: C27 H28 Cu N4 O7 S
• Title of publication: Sulfonated Schiff base copper(ii) complexes as efficient and selective catalysts in alcohol oxidation: syntheses and crystal structures
• Authors of publication: Hazra, Susanta; Martins, Luísa M. D. R. S.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.
• Journal of publication: RSC Advances
• Year of publication: 2015
• Journal volume: 5
• Journal issue: 109
• Pages of publication: 90079
• a: 7.9237 ± 0.0002 Å
• b: 11.2344 ± 0.0004 Å
• c: 16.0644 ± 0.0005 Å
• α: 103.893 ± 0.001°
• β: 96.378 ± 0.002°
• γ: 94.347 ± 0.001°
• Cell volume: 1371.79 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0563
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No