Information card for entry 7250450

Structure parameters

• Formula: C36 H90 Dy1.44 Er0.56 N32 O63
• Calculated formula: C36 H80 Dy1.44 Er0.56 N32 O63.0018
• Title of publication: Multicolor luminescence of supramolecular compounds based on mixed Dy-lanthanide complexes and cucurbit[6]uril for logic gate operation and WLED application.
• Authors of publication: Rakhmanova, Mariana I.; Sukhikh, Taisiya S.; Andrienko, Irina V.; Kovalenko, Ekaterina A.
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2025
• a: 25.8207 ± 0.0007 Å
• b: 25.8207 ± 0.0007 Å
• c: 31.7971 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 18359.2 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0528
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1303
• Goodness-of-fit parameter for all reflections included in the refinement: 1.183
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No