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Information card for entry 7209929
Preview
| Coordinates | 7209929.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H78 O56 S12 Tm2 |
|---|---|
| Calculated formula | C36 H78 O56 S12 Tm2 |
| Title of publication | Supramolecular assemblies with water-soluble p-sulfonatothiacalix[6]arene lanthanide complexes: one-dimensional ‘ladder-type’ coordination polymers and one-dimensional hydrogen-bonded polymers |
| Authors of publication | Yamada, Manabu; Hamada, Fumio |
| Journal of publication | CrystEngComm |
| Year of publication | 2013 |
| Journal volume | 15 |
| Journal issue | 28 |
| Pages of publication | 5703 |
| a | 15.4846 ± 0.0007 Å |
| b | 12.3023 ± 0.0005 Å |
| c | 20.5851 ± 0.0008 Å |
| α | 90° |
| β | 110.451 ± 0.0012° |
| γ | 90° |
| Cell volume | 3674.2 ± 0.3 Å3 |
| Cell temperature | 100.1 K |
| Ambient diffraction temperature | 100.1 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 significantly intense reflections | 0.0263 |
| Weighted residual factors for all reflections included in the refinement | 0.0619 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301863 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/20/ Each referenced PubChem compound corresponds to the full crystal structure. |
7209929.cif |
| 176453 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7209929.cif |
| 86880 | 2013-07-12 | cif/ Adding structures of 7209924, 7209925, 7209926, 7209927, 7209928, 7209929, 7209930 via cif-deposit CGI script. |
7209929.cif |
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Users of the data should acknowledge the original authors of the
structural data.