Information card for entry 1577299
| Formula |
C100 H106 N2 O4 |
| Calculated formula |
C100 H106 N2 O4 |
| Title of publication |
Colour by Design: Tuning the Solid-State Emission of Coronene Bisimide by Tailored Matrices |
| Authors of publication |
Soldner, Simon; Öçal, Ömer E; Shoyama, Kazutaka; Horneber, Dominik; Düreth, Johannes; Höfling, Sven; Klembt, Sebastian; Stolte, Matthias; Würthner, Frank |
| Journal of publication |
Chemical Science |
| Year of publication |
2026 |
| a |
12.751 ± 0.011 Å |
| b |
20.811 ± 0.017 Å |
| c |
31.27 ± 0.02 Å |
| α |
79.76 ± 0.05° |
| β |
83.11 ± 0.02° |
| γ |
79.64 ± 0.02° |
| Cell volume |
7999 ± 11 Å3 |
| Cell temperature |
100 ± 2 K |
| Ambient diffraction temperature |
100 ± 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 |
0.3491 |
| Residual factor for significantly intense reflections |
0.2166 |
| Weighted residual factors for significantly intense reflections |
0.5555 |
| Weighted residual factors for all reflections included in the refinement |
0.6259 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.382 |
| Diffraction radiation wavelength |
0.61989 Å |
| Diffraction radiation type |
synchrotron |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1577299.html
