Information card for entry 4344444

Structure parameters

• Formula: C29 H15 F18 N4 O6 Tb
• Calculated formula: C29 H15 F18 N4 O6 Tb
• SMILES: c1c2ccccc2[nH][n]1[Tb]123([n]4cc5ccccc5[nH]4)([O]=C(C(F)(F)F)C=C(C(F)(F)F)O1)([O]=C(C=C(C(F)(F)F)O2)C(F)(F)F)[O]=C(C=C(C(F)(F)F)O3)C(F)(F)F
• Title of publication: Efficient Layers of Emitting Ternary Lanthanide Complexes for Fabricating Red, Green, and Yellow OLEDs.
• Authors of publication: Ahmed, Zubair; Iftikhar, Khalid
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 23
• Pages of publication: 11209 - 11225
• a: 9.7278 ± 0.0003 Å
• b: 11.4273 ± 0.0004 Å
• c: 17.6049 ± 0.0007 Å
• α: 103.022 ± 0.002°
• β: 95.802 ± 0.002°
• γ: 98.031 ± 0.002°
• Cell volume: 1870.07 ± 0.12 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0574
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1375
• Weighted residual factors for all reflections included in the refinement: 0.147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No