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Information card for entry 2242741
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| Coordinates | 2242741.cif |
|---|---|
| Structure factors | 2242741.hkl |
| Original IUCr paper | HTML |
| Chemical name | (<i>E</i>)-4-Chloro-<i>N</i>'-(4-chlorobenzylidene)benzenesulfonohydrazide |
|---|---|
| Formula | C13 H10 Cl2 N2 O2 S |
| Calculated formula | C13 H10 Cl2 N2 O2 S |
| SMILES | c1(ccc(cc1)Cl)S(=O)(=O)N/N=C/c1ccc(cc1)Cl |
| Title of publication | Crystal structure and Hirshfeld surface analysis of two (<i>E</i>)-<i>N</i>'-(<i>para</i>-substituted benzylidene) 4-chlorobenzenesulfonohydrazides |
| Authors of publication | Salian, Akshatha R.; Foro, Sabine; Gowda, B. Thimme |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2018 |
| Journal volume | 74 |
| Journal issue | 12 |
| Pages of publication | 1808 - 1814 |
| a | 5.9306 ± 0.0006 Å |
| b | 9.477 ± 0.001 Å |
| c | 13.04 ± 0.002 Å |
| α | 98.822 ± 0.009° |
| β | 96.046 ± 0.009° |
| γ | 92.416 ± 0.009° |
| Cell volume | 718.94 ± 0.15 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0433 |
| Residual factor for significantly intense reflections | 0.0379 |
| Weighted residual factors for significantly intense reflections | 0.0981 |
| Weighted residual factors for all reflections included in the refinement | 0.1022 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 212034 (current) | 2018-11-17 | cif/ hkl/ Adding structures of 2242741, 2242742 via cif-deposit CGI script. |
2242741.cif 2242741.hkl |
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Users of the data should acknowledge the original authors of the
structural data.