Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2200010
2200009 << 2200010 >> 2200011Preview
|
Coordinates |
2200010.cif |
|
Structure factors |
2200010.hkl |
|
Original IUCr paper |
HTML |
Structure parameters
| Chemical name | 5-Acetyl-4-methyl-2-phenylamino-1,3-thiazole |
| Formula | - C12 H12 N2 O S - |
| Calculated formula | - C12 H12 N2 O S - |
| Title of publication | 5-Acetyl-4-methyl-2-phenylamino-1,3-thiazole |
| Authors of publication | Kasim, Noor Azilah M.; Yamin, Bohari M. |
| Journal of publication | Acta Crystallographica, Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 11 |
| Pages of publication | o3794 - o3795 |
| a | 12.932 ± 0.006 Å |
| b | 7.532 ± 0.003 Å |
| c | 24.322 ± 0.011 Å |
| α | 90° |
| β | 101.236 ± 0.009° |
| γ | 90° |
| Cell volume | 2323.6 ± 1.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.098 |
| Residual factor for observed reflections | 0.055 |
| Weighted residual factors for the observed reflections | 0.111 |
| Weighted residual factors for all reflections included in the refinement | 0.125 |
| Goodness-of-fit parameter for observed reflections | 1.02 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |