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Information card for entry 1543480
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| Coordinates | 1543480.cif |
|---|---|
| Structure factors | 1543480.hkl |
| Original IUCr paper | HTML |
| Chemical name | 2-Chloro-<i>N</i>-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetamide |
|---|---|
| Formula | C11 H8 Cl2 N2 O S |
| Calculated formula | C11 H8 Cl2 N2 O S |
| SMILES | s1cc(nc1NC(=O)CCl)c1ccc(Cl)cc1 |
| Title of publication | 2-Chloro-<i>N</i>-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetamide |
| Authors of publication | Saravanan, K.; Priya, K.; Anand, S. Athavan Alias; Kabilan, S.; Selvanayagam, S. |
| Journal of publication | IUCrData |
| Year of publication | 2016 |
| Journal volume | 1 |
| Journal issue | 6 |
| Pages of publication | x160903 |
| a | 5.094 ± 0.0012 Å |
| b | 14.738 ± 0.003 Å |
| c | 15.703 ± 0.003 Å |
| α | 90° |
| β | 96.932 ± 0.009° |
| γ | 90° |
| Cell volume | 1170.3 ± 0.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0818 |
| Residual factor for significantly intense reflections | 0.0627 |
| Weighted residual factors for significantly intense reflections | 0.1684 |
| Weighted residual factors for all reflections included in the refinement | 0.1776 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.977 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 183692 (current) | 2016-06-18 | cif/ hkl/ Adding structures of 1543480 via cif-deposit CGI script. |
1543480.cif 1543480.hkl |
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Users of the data should acknowledge the original authors of the
structural data.