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Information card for entry 7234652
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Coordinates | 7234652.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Pyrene, 1,3,6,8-tetrakis(4-fluorophenyl)- |
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Formula | C40 H22 F4 |
Calculated formula | C40 H22 F4 |
Title of publication | Tetraaryl pyrenes: photophysical properties, computational studies, crystal structures, and application in OLEDs |
Authors of publication | Tarek H. El-Assaad; Manuel Auer; Raul Castaneda; Kassem M. Hallal; Fadi M. Jradi; Lorenzo Mosca; Rony S. Khnayzer; Digambara Patra; Tatiana V. Timofeeva; Jean-Luc Bredas; Emil J. W. List-Kratochvil; Brigitte Wex; Bilal R. Kaafarani |
Journal of publication | Journal of Materials Chemistry C |
Year of publication | 2016 |
Journal volume | 4 |
Pages of publication | 3041 - 3058 |
a | 3.914 ± 0.003 Å |
b | 11.932 ± 0.01 Å |
c | 27.87 ± 0.02 Å |
α | 90° |
β | 90.739 ± 0.012° |
γ | 90° |
Cell volume | 1301.5 ± 1.7 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 3 |
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 | 0.1332 |
Residual factor for significantly intense reflections | 0.1071 |
Weighted residual factors for significantly intense reflections | 0.2833 |
Weighted residual factors for all reflections included in the refinement | 0.3119 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0639 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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