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Information card for entry 2101460
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| Coordinates | 2101460.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C16 H29 N2 Na O11 S3 |
|---|---|
| Calculated formula | C16 H29 N2 Na O11 S3 |
| SMILES | [Na+].C1(=C\C=C2\C(=O)N(CC(=O)[O-])C(=S)S2)/N(c2c(cccc2)S1)CC.O.O.O.O.O.O.O.O |
| Title of publication | Crystal and molecular structures of 3-acetyl-5-[2-(3-ethyl-2-benzothiazolidene)]ethylidenerhodanine and its lithium and sodium salts. Layered organic‒inorganic structures |
| Authors of publication | Nüesch, F.; Grätzel, M.; Nesper, R.; Shklover, V. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 1996 |
| Journal volume | 52 |
| Journal issue | 2 |
| Pages of publication | 277 - 286 |
| a | 46.209 ± 0.012 Å |
| b | 7.005 ± 0.007 Å |
| c | 16.583 ± 0.008 Å |
| α | 90° |
| β | 109.45 ± 0.04° |
| γ | 90° |
| Cell volume | 5061 ± 6 Å3 |
| Number of distinct elements | 6 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | Mo |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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