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Information card for entry 7020914
Preview
| Coordinates | 7020914.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C21 H15 Cl N4 Pt |
|---|---|
| Calculated formula | C21 H15 Cl N4 Pt |
| SMILES | [Pt]123N(c4cccc5ccc[n]3c45)C=CC=[N]1c1c3[n]2cccc3ccc1.[Cl-] |
| Title of publication | Photoluminescent DNA binding and cytotoxic activity of a platinum(ii) complex bearing a tetradentate β-diketiminate ligand. |
| Authors of publication | Hope, Jennifer M.; Wilson, Justin J.; Lippard, Stephen J. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2013 |
| Journal volume | 42 |
| Journal issue | 9 |
| Pages of publication | 3176 - 3180 |
| a | 28.326 ± 0.004 Å |
| b | 6.7809 ± 0.0009 Å |
| c | 25.61 ± 0.004 Å |
| α | 90° |
| β | 116.79 ± 0.002° |
| γ | 90° |
| Cell volume | 4391.1 ± 1.1 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.052952 |
| Residual factor for significantly intense reflections | 0.043895 |
| Weighted residual factors for all reflections included in the refinement | 0.127743 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01556 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301848 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/02/ Each referenced PubChem compound corresponds to the full crystal structure. |
7020914.cif |
| 179914 | 2016-03-25 | cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/09. |
7020914.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7020914.cif |
| 73713 | 2013-02-21 | cif/ Adding structures of 7020914 via cif-deposit CGI script. |
7020914.cif |
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Users of the data should acknowledge the original authors of the
structural data.