Information card for entry 7062065

Structure parameters

• Formula: C92 H138 Dy2 O14 P2
• Calculated formula: C92 H138 Dy2 O14 P2
• Title of publication: Multifunctional LnIII complexes with SMM, luminescence and MCE properties constructed using selected phosphine oxide and diketonate
• Authors of publication: Yan, Han; Che, Zi-Wei; Sun, Wen-Bin
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 1
• Pages of publication: 140 - 146
• a: 13.1963 ± 0.0006 Å
• b: 13.925 ± 0.0007 Å
• c: 15.1757 ± 0.0005 Å
• α: 85.183 ± 0.003°
• β: 86.395 ± 0.003°
• γ: 62.322 ± 0.005°
• Cell volume: 2459.9 ± 0.2 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.0921
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0805
• Goodness-of-fit parameter for all reflections included in the refinement: 0.923
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No