Information card for entry 1565634

Structure parameters

• Formula: C86 H66 Cu2 N2 O9 P4
• Calculated formula: C86 H66 Cu2 N2 O9 P4
• Title of publication: Fluorescence of copper(I) and mixed valence copper(I/II) complexes with dipicolinic acid and their catalytic activity on catechol oxidation
• Authors of publication: Moschovitis, K.; Banti, C.N.; Kourkoumelis, N.; Moushi, E.E.; Lazarides, T.; Hadjikakou, S.K.
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 500
• Pages of publication: 119209
• a: 9.5294 ± 0.0006 Å
• b: 11.8851 ± 0.0005 Å
• c: 16.5721 ± 0.0009 Å
• α: 91.86 ± 0.004°
• β: 91.189 ± 0.005°
• γ: 106.871 ± 0.005°
• Cell volume: 1794.3 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0867
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.1061
• Weighted residual factors for all reflections included in the refinement: 0.1256
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No