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Information card for entry 2237733
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| Coordinates | 2237733.cif |
|---|---|
| Structure factors | 2237733.hkl |
| Original IUCr paper | HTML |
| Chemical name | Chlorido[1,1'-(5-methyl-1,3-phenylene)bis(3,5-dimethyl-1<i>H</i>-imidazol-2-ylidene)]platinum(II) |
|---|---|
| Formula | C17 H19 Cl N4 Pt |
| Calculated formula | C17 H19 Cl N4 Pt |
| SMILES | [Pt]12(=C3N(C(=CN3C)C)c3c1c(cc(c3)C)N1C(=CN(C=21)C)C)Cl |
| Title of publication | Chlorido[1,1'-(5-methyl-1,3-phenylene)bis(3,5-dimethyl-1<i>H</i>-imidazol-2-ylidene)]platinum(II) |
| Authors of publication | Peng, Kui-Juan; Wang, Zi-Xing; Wan, Wen |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 4 |
| Pages of publication | m218 |
| a | 11.042 ± 0.005 Å |
| b | 14.552 ± 0.006 Å |
| c | 11.524 ± 0.005 Å |
| α | 90° |
| β | 116.049 ± 0.004° |
| γ | 90° |
| Cell volume | 1663.6 ± 1.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 all reflections | 0.0343 |
| Residual factor for significantly intense reflections | 0.029 |
| Weighted residual factors for significantly intense reflections | 0.0775 |
| Weighted residual factors for all reflections included in the refinement | 0.0802 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181299 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/77. |
2237733.cif 2237733.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2237733.cif 2237733.hkl |
| 88055 | 2013-08-28 | cod/cif/ (saulius@koala.ibt.lt) Adding the _cod_database_fobs_code links for those COD CIFs that have their Fobs deposited recently. |
2237733.cif 2237733.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2237733.cif 2237733.hkl |
| 85494 | 2013-05-07 | cif/ Adding structures of 2237733 via cif-deposit CGI script. |
2237733.cif |
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Users of the data should acknowledge the original authors of the
structural data.