Information card for entry 7711093

Structure parameters

• Formula: C25 H10 Eu F18 N3 O6 S
• Calculated formula: C25 H10 Eu F18 N3 O6 S
• SMILES: [Eu]1234([O]=C(C=C(O1)C(F)(F)F)C(F)(F)F)([O]=C(C(F)(F)F)C=C(O2)C(F)(F)F)([O]=C(C(F)(F)F)C=C(O3)C(F)(F)F)[n]1c2ccccc2[nH]c1c1[n]4csc1
• Title of publication: Single component white-OLEDs derived from tris(β-diketonato) europium(III) complexes bearing the large bite angle N^N 2-(4-thiazolyl)benzimidazole ligand
• Authors of publication: Ilmi, Rashid; Yin, Jiaxuan; Dutra, Jose D. L.; Al Rasbi, Nawal K.; Oliveira, Willyan F.; Zhou, Liang; Wong, Wai-Yeung Raymond; Raithby, Paul R.; Khan, Muhammad S.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.72 ± 0.0019 Å
• b: 12.77 ± 0.003 Å
• c: 14.3 ± 0.003 Å
• α: 82.8 ± 0.03°
• β: 76.7 ± 0.03°
• γ: 83.9 ± 0.03°
• Cell volume: 1708.2 ± 0.7 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0628
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1256
• Weighted residual factors for all reflections included in the refinement: 0.1379
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No