Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2013111
2013110 << 2013111 >> 2013112Preview
|
Coordinates |
2013111.cif |
|
Structure factors |
2013111.hkl |
Structure parameters
| Formula | - C11 H9 Cl N5 O0.5 S - |
| Calculated formula | - C11 H9 Cl N5 O0.5 S - |
| Title of publication | Three 2-aminopurine derivatives |
| Authors of publication | Daniel E. Lynch; Ian McClenaghan |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2003 |
| Journal volume | 59 |
| Pages of publication | o53 - o56 |
| a | 13.353 ± 0.003 Å |
| b | 7.743 ± 0.002 Å |
| c | 47.6 ± 0.01 Å |
| α | 90° |
| β | 95.85 ± 0.03° |
| γ | 90° |
| Cell volume | 4896 ± 2 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | C 1 2/c 1 |
| Hall symmetry space group | -C 2yc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |