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Information card for entry 7057372
Preview
Coordinates | 7057372.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 2PPI-TPE |
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Formula | C68 H44 N4 |
Calculated formula | C68 H44 N4 |
Title of publication | Novel phenanthroimidazole-based blue AIEgens: reversible mechanochromism, bipolar transporting properties, and electroluminescence |
Authors of publication | Wang, Zhong-Yi; Zhao, Jue-Wen; Li, Peng; Feng, Tong; Wang, Wen-Jian; Tao, Si-Lu; Tong, Qing-Xiao |
Journal of publication | New Journal of Chemistry |
Year of publication | 2018 |
Journal volume | 42 |
Journal issue | 11 |
Pages of publication | 8924 |
a | 9.53878 ± 0.00016 Å |
b | 16.807 ± 0.0003 Å |
c | 18.0235 ± 0.0003 Å |
α | 103.584 ± 0.0014° |
β | 104.834 ± 0.0014° |
γ | 91.8775 ± 0.0014° |
Cell volume | 2701.76 ± 0.08 Å3 |
Cell temperature | 300 ± 0.1 K |
Ambient diffraction temperature | 300 ± 0.1 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0485 |
Residual factor for significantly intense reflections | 0.0392 |
Weighted residual factors for significantly intense reflections | 0.1055 |
Weighted residual factors for all reflections included in the refinement | 0.111 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7057372.html
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