Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2014713
2014712 << 2014713 >> 2014714Preview
|
Coordinates |
2014713.cif |
|
Structure factors |
2014713.hkl |
Structure parameters
| Common name | 2-amino-4,6-dimethylpyrimidinium hydrogensulfate |
| Formula | - C6 H11 N3 O4 S - |
| Calculated formula | - C6 H11 N3 O4 S - |
| Title of publication | Hydrogen-bonding patterns in 2-amino-4,6-dimethylpyrimidinium hydrogen sulfate |
| Authors of publication | Madhukar Hemamalini; Packianathan Thomas Muthiah; Urszula Rychlewska; Agnieszka Plutecka |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2005 |
| Journal volume | 61 |
| Pages of publication | o95 - o97 |
| a | 7.025 ± 0.001 Å |
| b | 6.724 ± 0.001 Å |
| c | 20.2 ± 0.004 Å |
| α | 90° |
| β | 90.27 ± 0.03° |
| γ | 90° |
| Cell volume | 954.2 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |