Information card for entry 7057976

Structure parameters

• Formula: C48 H88 Cu3 N6 O30
• Calculated formula: C48 H88 Cu3 N6 O30
• Title of publication: Synthesis, crystal structures, photoluminescence, magnetic and antioxidant properties, and theoretical analysis of Zn(ii) and Cu(ii) complexes of an aminoalcohol ligand supported by benzoate counter anions
• Authors of publication: I., Mantasha; Shahid, M.; Ahmad, Musheer; Rahisuddin, Rahisuddin; Arif, Rizwan; Tasneem, Sana; Sama, Farasha; Ansari, Istikhar A.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 2
• Pages of publication: 622
• a: 8.8047 ± 0.0019 Å
• b: 11.724 ± 0.003 Å
• c: 15.674 ± 0.004 Å
• α: 79.582 ± 0.007°
• β: 81.993 ± 0.006°
• γ: 89.202 ± 0.006°
• Cell volume: 1575.7 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0777
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for significantly intense reflections: 0.1798
• Weighted residual factors for all reflections included in the refinement: 0.1904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No