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Information card for entry 4339927
Preview
| Coordinates | 4339927.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H24 N4 O2 Pt |
|---|---|
| Calculated formula | C26 H24 N4 O2 Pt |
| SMILES | [Pt]12(OC(=O)c3[n]1cccc3)[n]1cc3ccccc3cc1c1n2nc2c1[C@@H]1C([C@]2(CC1)C)(C)C |
| Title of publication | Luminescent platinum(II) complexes containing isoquinolinyl indazolate ligands: synthetic reaction pathway and photophysical properties. |
| Authors of publication | Chang, Sheng-Yuan; Kavitha, Jakka; Hung, Jui-Yi; Chi, Yun; Cheng, Yi-Ming; Li, Elise Y.; Chou, Pi-Tai; Lee, Gene-Hsiang; Carty, Arthur J. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2007 |
| Journal volume | 46 |
| Journal issue | 17 |
| Pages of publication | 7064 - 7074 |
| a | 10.4558 ± 0.0001 Å |
| b | 19.501 ± 0.0002 Å |
| c | 10.8625 ± 0.0001 Å |
| α | 90° |
| β | 96.9912 ± 0.0008° |
| γ | 90° |
| Cell volume | 2198.38 ± 0.04 Å3 |
| Cell temperature | 150 ± 1 K |
| Ambient diffraction temperature | 150 ± 1 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0277 |
| Residual factor for significantly intense reflections | 0.0262 |
| Weighted residual factors for significantly intense reflections | 0.064 |
| Weighted residual factors for all reflections included in the refinement | 0.0647 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301839 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure. |
4339927.cif |
| 179502 | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/99. |
4339927.cif |
| 117620 | 2014-06-15 | cif/ Adding structures of 4339927 via cif-deposit CGI script. |
4339927.cif |
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Users of the data should acknowledge the original authors of the
structural data.