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Information card for entry 1558919
Preview
| Coordinates | 1558919.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 7,9,10,12-tetrahydrodithieno[3,2-f:2',3'-h][1,4]dioxecine |
|---|---|
| Formula | C12 H12 O2 S2 |
| Calculated formula | C12 O2 S2 |
| SMILES | C1OCc2c(scc2)c2c(COC1)ccs2 |
| Title of publication | Synthesis of Novel Crown Ethers Derived from 3,3'-Dimethyl-2,2'-Bithienylene and Preparation of alpha,omega-Bis(3-methylenethienyl) Ethers |
| Authors of publication | Zimmer, Hans; Amer, Adel; Shabana, R.; Ho, Douglas; Mark, Jr., Harry B.; Sudsuansri, Kobkul; Striley, Cindy |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1993 |
| Journal volume | 47 |
| Pages of publication | 184 - 190 |
| a | 6.927 ± 0.0005 Å |
| b | 6.927 ± 0.0005 Å |
| c | 25.0785 ± 0.0036 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1203.3 ± 0.2 Å3 |
| Ambient diffraction temperature | 294 K |
| Number of distinct elements | 4 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for significantly intense reflections | 0.0246 |
| Weighted residual factors for significantly intense reflections | 0.0291 |
| Goodness-of-fit parameter for all reflections included in the refinement | 2.17 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 255687 (current) | 2020-08-27 | cif/ Adding structures of 1558919 via cif-deposit CGI script. |
1558919.cif |
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