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Information card for entry 1553675
Preview
Coordinates | 1553675.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H29 N O2 |
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Calculated formula | C42 H29 N O2 |
SMILES | O(c1ccc(cc1)c1ccc2oc(c(c2c1)C#N)c1ccc(cc1)C(=C(c1ccccc1)c1ccccc1)c1ccccc1)C |
Title of publication | Turning on the solid emission from non-emissive 2-aryl-3-cyanobenzofurans by tethering tetraphenylethene for green electroluminescence |
Authors of publication | Peng, Zhixing; Huang, Kai; Tao, Yuhan; Li, Xihui; Zhang, Lianpeng; Lu, Ping; Wang, Yanguang |
Journal of publication | Materials Chemistry Frontiers |
Year of publication | 2017 |
Journal volume | 1 |
Journal issue | 9 |
Pages of publication | 1858 |
a | 18.2932 ± 0.001 Å |
b | 19.3313 ± 0.0009 Å |
c | 9.1613 ± 0.0006 Å |
α | 90° |
β | 103.67 ± 0.006° |
γ | 90° |
Cell volume | 3148 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293.15 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1067 |
Residual factor for significantly intense reflections | 0.0593 |
Weighted residual factors for significantly intense reflections | 0.139 |
Weighted residual factors for all reflections included in the refinement | 0.1674 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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