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Information card for entry 2241384
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| Coordinates | 2241384.cif |
|---|---|
| Structure factors | 2241384.hkl |
| Original IUCr paper | HTML |
| Chemical name | (<i>Z</i>)-3-Allyl-5-(4-chlorobenzylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
|---|---|
| Formula | C13 H10 Cl N O S2 |
| Calculated formula | C13 H10 Cl N O S2 |
| Title of publication | Crystal structure of (<i>Z</i>)-3-allyl-5-(4-chlorobenzylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Authors of publication | El Ajlaoui, Rahhal; Rakib, El Mostapha; Mojahidi, Souad; Saadi, Mohamed; El Ammari, Lahcen |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 12 |
| Pages of publication | o1012 |
| a | 7.6197 ± 0.0008 Å |
| b | 7.9849 ± 0.0007 Å |
| c | 13.0624 ± 0.0014 Å |
| α | 77.6 ± 0.005° |
| β | 77.996 ± 0.005° |
| γ | 61.954 ± 0.004° |
| Cell volume | 679.76 ± 0.12 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0732 |
| Residual factor for significantly intense reflections | 0.0467 |
| Weighted residual factors for significantly intense reflections | 0.1215 |
| Weighted residual factors for all reflections included in the refinement | 0.1438 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181914 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/13. |
2241384.cif 2241384.hkl |
| 171465 | 2015-12-13 | cif/ hkl/ Adding structures of 2241384 via cif-deposit CGI script. |
2241384.cif 2241384.hkl |
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Users of the data should acknowledge the original authors of the
structural data.