Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2013729
2013728 << 2013729 >> 2013730Preview
|
Coordinates |
2013729.cif |
|
Structure factors |
2013729.hkl |
Structure parameters
| Formula | - C2 H4 N4 S - |
| Calculated formula | - C2 H4 N4 S - |
| Title of publication | Two dimorphs of 5-methylsulfanyl-1H-tetrazole |
| Authors of publication | Natalya Fridman; Moshe Kapon; Menahem Kaftory |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2004 |
| Journal volume | 60 |
| Pages of publication | o47 - o49 |
| a | 5.041 ± 0.001 Å |
| b | 6.547 ± 0.001 Å |
| c | 7.247 ± 0.001 Å |
| α | 90° |
| β | 96.98 ± 0.02° |
| γ | 90° |
| Cell volume | 237.4 ± 0.07 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/m 1 |
| Hall symmetry space group | -P 2yb |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |