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CIF Information Card
Information card for 2200172
2200171 << 2200172 >> 2200173Preview
|
Coordinates |
2200172.cif |
Structure parameters
| Formula | - C18 H14 Cl N5 - |
| Calculated formula | - C18 H14 Cl N5 - |
| Title of publication | 1-(2-Pyridyl)-8H-pyrrolo[2,1-c]-s-triazolo[4,3-a][1,4]benzodiazepinium chloride |
| Authors of publication | Kubicki, Maciej; Codding, Penelope W. |
| Journal of publication | Acta Crystallographica, Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Pages of publication | o122 - o124 |
| a | 8.7856 ± 0.0005 Å |
| b | 8.2058 ± 0.0005 Å |
| c | 22.99 ± 0.002 Å |
| α | 90° |
| β | 95.513 ± 0.006° |
| γ | 90° |
| Cell volume | 1649.8 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |