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Information card for entry 2008560
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| Coordinates | 2008560.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Ethylene bis(dimethyldithiocarbamate) |
|---|---|
| Formula | C8 H16 N2 S4 |
| Calculated formula | C8 H16 N2 S4 |
| SMILES | CN(C(=S)SCCSC(=S)N(C)C)C |
| Title of publication | Ethylene bis(dimethyldithiocarbamate) and butane-1,4-diyl bis(dimethyldithiocarbamate) |
| Authors of publication | Jian Fangfang; Zhu Dunru; Fun Hoong-Kun; Kandasamy Chinnakali; Ibrahim Abdul Razak; You Xiaozeng |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1999 |
| Journal volume | 55 |
| Journal issue | 6 |
| Pages of publication | 940 - 942 |
| a | 6.069 ± 0.007 Å |
| b | 7.829 ± 0.002 Å |
| c | 13.455 ± 0.003 Å |
| α | 90° |
| β | 91.76 ± 0.03° |
| γ | 90° |
| Cell volume | 639 ± 0.8 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0687 |
| Residual factor for significantly intense reflections | 0.041 |
| Weighted residual factors for all reflections included in the refinement | 0.0954 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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