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Information card for entry 2202113
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| Coordinates | 2202113.cif |
|---|---|
| Structure factors | 2202113.hkl |
| Original IUCr paper | HTML |
| Chemical name | N,N'-Bis(benzamidothiocarbonyl)hydrazine dimethyl sulfoxide disolvate |
|---|---|
| Formula | C20 H26 N4 O4 S4 |
| Calculated formula | C20 H26 N4 O4 S4 |
| SMILES | S=C(NC(=O)c1ccccc1)NNC(=S)NC(=O)c1ccccc1.CS(=O)C.CS(=O)C |
| Title of publication | <i>N,N</i>'-Bis(benzamidothiocarbonyl)hydrazine dimethyl sulfoxide disolvate |
| Authors of publication | Bohari M. Yamin; M.Sukeri M. Yusof |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2003 |
| Journal volume | 59 |
| Journal issue | 3 |
| Pages of publication | o358 - o359 |
| a | 6.4127 ± 0.0011 Å |
| b | 15.486 ± 0.003 Å |
| c | 12.805 ± 0.002 Å |
| α | 90° |
| β | 93.971 ± 0.003° |
| γ | 90° |
| Cell volume | 1268.6 ± 0.4 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.084 |
| Residual factor for significantly intense reflections | 0.055 |
| Weighted residual factors for significantly intense reflections | 0.121 |
| Weighted residual factors for all reflections included in the refinement | 0.135 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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