Information card for entry 7207829
| Common name |
Barbituric acid |
| Chemical name |
2,4,6(1H,3H,5H)-pyrimidinetrione |
| Formula |
C4 H4 N2 O3 |
| Calculated formula |
C4 H4 N2 O3 |
| Title of publication |
On the high-temperature phase of barbituric acid |
| Authors of publication |
Többens, Daniel M.; Glinneman, Jürgen; Chierotti, Michele R.; van de Streek, Jacco; Sheptyakov, Denis |
| Journal of publication |
CrystEngComm |
| Year of publication |
2012 |
| Journal volume |
14 |
| Journal issue |
9 |
| Pages of publication |
3046 |
| a |
8.5302 ± 0.0003 Å |
| b |
6.8167 ± 0.0003 Å |
| c |
9.3304 ± 0.0004 Å |
| α |
90° |
| β |
89.865 ± 0.002° |
| γ |
90° |
| Cell volume |
542.54 ± 0.04 Å3 |
| Cell temperature |
509 K |
| Ambient diffraction temperature |
509 K |
| Number of distinct elements |
4 |
| Space group number |
15 |
| Hermann-Mauguin space group symbol |
C 1 2/c 1 |
| Hall space group symbol |
-C 2yc |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7207829.html
