Information card for entry 2210946
| Chemical name |
5-(4-Chlorophenoxy)-3,6-diphenyl-2-thioxo-2,3-dihydrothiazolo [4,5-d]pyrimidin-7(6H)-one dichloromethane solvate |
| Formula |
C23.5 H15 Cl2 N3 O2 S2 |
| Calculated formula |
C23.5 H15 Cl2 N3 O2 S2 |
| Title of publication |
5-(4-Chlorophenoxy)-3,6-diphenyl-2-thioxo-2,3-dihydrothiazolo[4,5-<i>d</i>]pyrimidin-7(6<i>H</i>)-one dichloromethane hemisolvate |
| Authors of publication |
Liang, Ying; Xu, Di-Fan; He, Hong-Wu |
| Journal of publication |
Acta Crystallographica Section E |
| Year of publication |
2006 |
| Journal volume |
62 |
| Journal issue |
11 |
| Pages of publication |
o4868 - o4869 |
| a |
9.548 ± 0.0007 Å |
| b |
11.1732 ± 0.0009 Å |
| c |
11.9096 ± 0.0009 Å |
| α |
75.307 ± 0.001° |
| β |
77.922 ± 0.001° |
| γ |
68.403 ± 0.001° |
| Cell volume |
1133.18 ± 0.15 Å3 |
| Cell temperature |
292 ± 2 K |
| Ambient diffraction temperature |
292 ± 2 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 |
0.0685 |
| Residual factor for significantly intense reflections |
0.0581 |
| Weighted residual factors for significantly intense reflections |
0.1616 |
| Weighted residual factors for all reflections included in the refinement |
0.1697 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.056 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
Yes |
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https://www.crystallography.net/2210946.html
