Information card for entry 7235053

Structure parameters

• Formula: C51 H45.64 O9.48 S3 Yb
• Calculated formula: C51 H45.64 O9.48 S3 Yb
• Title of publication: Lanthanide 9-anthracenate: solution processable emitters for efficient purely NIR emitting host-free OLEDs
• Authors of publication: Valentina V. Utochnikova; Alena S. Kalyakina; Ivan S. Bushmarinov; Andrey A. Vashchenko; Lukasz Marciniak; Anna M. Kaczmarek; Rik Van Deun; Stefan Brase; Natalia P. Kuzmina
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2016
• Journal volume: 4
• Pages of publication: 9848 - 9855
• a: 21.337 ± 0.003 Å
• b: 21.337 ± 0.003 Å
• c: 8.7908 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3466 ± 0.8 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0177
• Residual factor for significantly intense reflections: 0.0177
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.0427
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No