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Information card for entry 1557501
Preview
| Coordinates | 1557501.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C30 H34 Br2 F6 N4 O6 P2 Pt S2 |
|---|---|
| Calculated formula | C30 H34 Br2 F6 N4 O6 P2 Pt S2 |
| SMILES | [Pt]12([n]3c(c4[n]2ccc(Br)c4)cc(Br)cc3)[P@@](C)(C(C)(C)C)c2nc3c(nc2[P@@]1(C(C)(C)C)C)cccc3.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F |
| Title of publication | Synthesis of Platinum-Containing Conjugated Polymers Having QuinoxP* and Bipyridine Ligands. Chirality Transfer from the Phosphine Ligand to the Polymer Backbone |
| Authors of publication | Marumoto, Manabu; Sotani, Taichi; Miyagi, Yu; Yajima, Tatsuo; Sano, Natsuhiro; Sanda, Fumio |
| Journal of publication | Macromolecules |
| Year of publication | 2020 |
| Journal volume | 53 |
| Journal issue | 6 |
| Pages of publication | 2031 - 2038 |
| a | 11.5406 ± 0.0002 Å |
| b | 18.5416 ± 0.0003 Å |
| c | 18.7269 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4007.2 ± 0.11 Å3 |
| Cell temperature | 123 K |
| Ambient diffraction temperature | 123 K |
| Number of distinct elements | 9 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0303 |
| Residual factor for significantly intense reflections | 0.0273 |
| Weighted residual factors for significantly intense reflections | 0.0629 |
| Weighted residual factors for all reflections included in the refinement | 0.0642 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301780 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 1/55 Each referenced PubChem compound corresponds to the full crystal structure. |
1557501.cif |
| 257166 | 2020-10-04 | cif/ Updating files of 1557501 Original log message: Adding full bibliography for 1557501.cif. |
1557501.cif |
| 250120 | 2020-04-04 | cif/ Updating files of 1557501 Original log message: Adding full bibliography for 1557501.cif. |
1557501.cif |
| 249097 | 2020-03-06 | cif/ Adding structures of 1557501 via cif-deposit CGI script. |
1557501.cif |
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