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CIF Information Card
Information card for 2014598
2014597 << 2014598 >> 2014599Preview
|
Coordinates |
2014598.cif |
Structure parameters
| Formula | - C14 H11 Cl3 N4 O2 - |
| Calculated formula | - C14 H11 Cl3 N4 O2 - |
| Title of publication | 8-Chloro-7-(2,6-dichlorobenzyl)-1,3-dimethyl-7H-purine-2,6(1H,3H)-dione |
| Authors of publication | Belyakov, Sergey; Alksnis, Edgars; Muravenko, Velta; Lukevics, Edmunds |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2005 |
| Journal volume | 61 |
| Pages of publication | o63 - o64 |
| a | 8.4073 ± 0.0002 Å |
| b | 8.6544 ± 0.0003 Å |
| c | 11.8014 ± 0.0004 Å |
| α | 71.814 ± 0.0014° |
| β | 70.7538 ± 0.0013° |
| γ | 82.343 ± 0.002° |
| Cell volume | 769.74 ± 0.04 Å3 |
| Cell temperature | 293 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |