Information card for entry 7234485

Structure parameters

• Formula: C38 H34 Cl4 F6 N6 Pt
• Calculated formula: C38 H34 Cl4 F6 N6 Pt
• SMILES: [Pt]12([n]3c(c4[n]2ccc(c4)c2c(cc(cc2C)C)C)cc(cc3)c2c(cc(cc2C)C)C)n2nc(C(F)(F)F)cc2c2n1nc(c2)C(F)(F)F.C(Cl)Cl.C(Cl)Cl
• Title of publication: Efficient Pt(ii) emitters assembled from neutral bipyridine and dianionic bipyrazolate: designs, photophysical characterization and the fabrication of non-doped OLEDs
• Authors of publication: Che-Wei Hsu; Yongbiao Zhao; Hsiu-Hsuan Yeh; Chin-Wei Lu; Cong Fan; Yue Hu; Neil Robertson; Gene-Hsiang Lee; Xiao Wei Sun; Yun Chi
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2015
• Journal volume: 3
• Pages of publication: 10837 - 10847
• a: 11.3477 ± 0.0011 Å
• b: 17.9505 ± 0.0016 Å
• c: 19.3631 ± 0.0018 Å
• α: 90°
• β: 95.698 ± 0.002°
• γ: 90°
• Cell volume: 3924.7 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0609
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1174
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No