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Information card for entry 1554252
Preview
Coordinates | 1554252.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C45 H29 N5 |
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Calculated formula | C45 H29 N5 |
SMILES | n1c2c3ccccc3c3ccccc3c2n(c1c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)c1nn2c(n1)cccc2)c1ccccc1 |
Title of publication | A novel D‒π‒A blue fluorophore based on [1,2,4]triazolo[1,5-a]pyridine as an electron acceptor and its application in organic light-emitting diodes |
Authors of publication | Cao, Chen; Chen, Wen-Cheng; Tian, Shuang; Chen, Jia-Xiong; Wang, Zhong-Yi; Zheng, Xu-Hui; Ding, Chong-Wei; Li, Jing-Hong; Zhu, Jie-Ji; Zhu, Ze-Lin; Tong, Qing-Xiao; Lee, Chun-Sing |
Journal of publication | Materials Chemistry Frontiers |
Year of publication | 2019 |
Journal volume | 3 |
Journal issue | 6 |
Pages of publication | 1071 |
a | 8.9145 ± 0.0003 Å |
b | 13.2762 ± 0.0004 Å |
c | 14.5859 ± 0.0005 Å |
α | 110.467 ± 0.002° |
β | 98.648 ± 0.002° |
γ | 96.716 ± 0.002° |
Cell volume | 1571.88 ± 0.09 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 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 | 0.069 |
Residual factor for significantly intense reflections | 0.0588 |
Weighted residual factors for significantly intense reflections | 0.1557 |
Weighted residual factors for all reflections included in the refinement | 0.1674 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.975 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1554252.html
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