Information card for entry 1515465
| Formula |
C40 H28 |
| Calculated formula |
C40 H28 |
| SMILES |
c1(ccc(cc1)c1c2ccccc2cc2ccccc12)C(=C(c1ccccc1)c1ccccc1)c1ccccc1 |
| Title of publication |
Molecular anchors in the solid state: Restriction of intramolecular rotation boosts emission efficiency of luminogen aggregates to unity |
| Authors of publication |
Zhao, Zujin; Lu, Ping; Lam, Jacky W. Y.; Wang, Zhiming; Chan, Carrie Y. K.; Sung, Herman H. Y.; Williams, Ian D.; Ma, Yuguang; Tang, Ben Zhong |
| Journal of publication |
Chemical Science |
| Year of publication |
2011 |
| Journal volume |
2 |
| Journal issue |
4 |
| Pages of publication |
672 |
| a |
9.485 ± 0.0008 Å |
| b |
9.683 ± 0.0009 Å |
| c |
15.5796 ± 0.0014 Å |
| α |
79.592 ± 0.008° |
| β |
83.901 ± 0.007° |
| γ |
85.662 ± 0.007° |
| Cell volume |
1397 ± 0.2 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 ± 2 K |
| Number of distinct elements |
2 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0573 |
| Residual factor for significantly intense reflections |
0.0378 |
| Weighted residual factors for significantly intense reflections |
0.0823 |
| Weighted residual factors for all reflections included in the refinement |
0.0866 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.015 |
| 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/1515465.html
