Information card for entry 7206058
| Formula |
C39 H30 N2 S |
| Calculated formula |
C39 H30 N2 S |
| SMILES |
s1c(c2n(c3c(n2)c2c(c4c3cccc4)cccc2)c2ccc(cc2)C(C)(C)C)ccc1c1c2c(ccc1)cccc2 |
| Title of publication |
Synthesis and characterization of phenanthroimidazole derivatives for applications in organic electroluminescent devices |
| Authors of publication |
Zhang, Ying; Lai, Shiu-Lun; Tong, Qing-Xiao; Chan, Mei-Yee; Ng, Tsz-Wai; Wen, Zhi-Chun; Zhang, Guo-Qiang; Lee, Shuit-Tong; Kwong, Hoi-Lun; Lee, Chun-Sing |
| Journal of publication |
Journal of Materials Chemistry |
| Year of publication |
2011 |
| Journal volume |
21 |
| Journal issue |
22 |
| Pages of publication |
8206 |
| a |
9.4051 ± 0.0008 Å |
| b |
11.1593 ± 0.001 Å |
| c |
14.825 ± 0.0013 Å |
| α |
106.358 ± 0.001° |
| β |
97.975 ± 0.001° |
| γ |
101.611 ± 0.001° |
| Cell volume |
1430.5 ± 0.2 Å3 |
| Cell temperature |
298 ± 2 K |
| Ambient diffraction temperature |
298 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0497 |
| Residual factor for significantly intense reflections |
0.0427 |
| Weighted residual factors for significantly intense reflections |
0.1212 |
| Weighted residual factors for all reflections included in the refinement |
0.1326 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.073 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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