Information card for entry 4518390
| Chemical name |
N2,N2-dimethyl-N4-(3-(2-(pentafluorophenyl)vinyl)phenyl) -N6-phenyl-1,3,5-triazine-2,4,6-triamine dimethyl sulfoxide solvate |
| Formula |
C29 H31 F5 N6 O2 S2 |
| Calculated formula |
C29 H31 F5 N6 O2 S2 |
| Title of publication |
Glass versus Crystal: A Balancing Act between Competing Intermolecular Interactions |
| Authors of publication |
Laventure, Audrey; Maris, Thierry; Pellerin, Christian; Lebel, Olivier |
| Journal of publication |
Crystal Growth and Design |
| Year of publication |
2017 |
| Journal volume |
17 |
| Pages of publication |
2365 - 2373 |
| a |
7.9866 ± 0.0003 Å |
| b |
11.0761 ± 0.0004 Å |
| c |
17.215 ± 0.0006 Å |
| α |
90.6702 ± 0.0017° |
| β |
99.6908 ± 0.0017° |
| γ |
99.059 ± 0.0017° |
| Cell volume |
1481.25 ± 0.09 Å3 |
| Cell temperature |
110 K |
| Ambient diffraction temperature |
110 K |
| Number of distinct elements |
6 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0675 |
| Residual factor for significantly intense reflections |
0.0563 |
| Weighted residual factors for significantly intense reflections |
0.1449 |
| Weighted residual factors for all reflections included in the refinement |
0.1537 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.027 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
1.34139 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/4518390.html
