Information card for entry 7701251

Structure parameters

• Formula: C32 H40 Cu4 F12 N8
• Calculated formula: C32.003 H40 Cu4 F12.009 N8
• Title of publication: Brightly phosphorescent tetranuclear copper(i) pyrazolates.
• Authors of publication: Dias, H. V. Rasika; Diyabalanage, Himashinie V. K.; Ghimire, Mukunda M.; Hudson, Joshua M.; Parasar, Devaborniny; Palehepitiya Gamage, Chammi S.; Li, Shan; Omary, Mohammad A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 40
• Pages of publication: 14979 - 14983
• a: 9.7771 ± 0.0004 Å
• b: 11.5138 ± 0.0004 Å
• c: 18.98 ± 0.0007 Å
• α: 90.278 ± 0.001°
• β: 92.855 ± 0.001°
• γ: 107.145 ± 0.001°
• Cell volume: 2038.7 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 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: 0.0784
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1138
• Weighted residual factors for all reflections included in the refinement: 0.1263
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No