Information card for entry 4347378

Structure parameters

• Formula: C29 H34 F6 N6 O Pt
• Calculated formula: C29 H34 F6 N6 O Pt
• SMILES: [Pt]12(c3cc(ccc3c3n1nc(c3)C(F)(F)F)C(F)(F)F)=C1N(C=CN1CCCN1C=2N(C=C1)C(C)C)C(C)C.O=C(C)C
• Title of publication: Pt(II) Phosphors Featuring Both Dicarbene and Functional Biazolate Chelates: Synthesis, Luminescent Properties, and Applications in Organic Light-Emitting Diodes.
• Authors of publication: Liao, Jia-Ling; Chi, Yun; Wang, Jin-Yun; Chen, Zhong-Ning; Tsai, Zheng-Hua; Hung, Wen-Yi; Tseng, Meu-Rurng; Lee, Gene-Hsiang
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 13
• Pages of publication: 6394 - 6404
• a: 10.2995 ± 0.0006 Å
• b: 10.7219 ± 0.0006 Å
• c: 14.7831 ± 0.0008 Å
• α: 96.1523 ± 0.0012°
• β: 103.387 ± 0.0012°
• γ: 98.3918 ± 0.0012°
• Cell volume: 1554.2 ± 0.15 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0337
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.0661
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No