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Information card for entry 2243427
Preview
| Coordinates | 2243427.cif |
|---|---|
| Structure factors | 2243427.hkl |
| Original IUCr paper | HTML |
| Chemical name | (η^2^-2-Allyl-4-methoxy-5-{[(propan-2-yloxy)carbonyl]methoxy}phenyl-κ<i>C</i>^1^)chlorido(pyridine-4-carboxylic acid-κN)platinum(II) |
|---|---|
| Formula | C21 H24 Cl N O6 Pt |
| Calculated formula | C21 H24 Cl N O6 Pt |
| SMILES | [Pt]12(c3c(cc(c(c3)OCC(=O)OC(C)C)OC)C[CH]1=[CH2]2)(Cl)[n]1ccc(cc1)C(=O)O |
| Title of publication | Crystal structures of three platinacyclic complexes bearing isopropyl eugenoxyacetate and pyridine derivatives |
| Authors of publication | Chi, Nguyen Thi Thanh; Thong, Pham Van; Van Meervelt, Luc |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2020 |
| Journal volume | 76 |
| Journal issue | 7 |
| Pages of publication | 1012 - 1017 |
| a | 7.8746 ± 0.0002 Å |
| b | 9.7566 ± 0.0002 Å |
| c | 15.0004 ± 0.0004 Å |
| α | 95.782 ± 0.002° |
| β | 102.874 ± 0.002° |
| γ | 93.843 ± 0.002° |
| Cell volume | 1113.02 ± 0.05 Å3 |
| Cell temperature | 100.01 ± 0.1 K |
| Ambient diffraction temperature | 100.01 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0292 |
| Residual factor for significantly intense reflections | 0.0268 |
| Weighted residual factors for significantly intense reflections | 0.0659 |
| Weighted residual factors for all reflections included in the refinement | 0.0683 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 252982 (current) | 2020-06-06 | cif/ hkl/ Adding structures of 2243425, 2243426, 2243427 via cif-deposit CGI script. |
2243427.cif 2243427.hkl |
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Users of the data should acknowledge the original authors of the
structural data.