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Information card for entry 2234426
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| Coordinates | 2234426.cif |
|---|---|
| Structure factors | 2234426.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>cis</i>-(Di-2-pyridylamine-κ^2^<i>N</i>^2^,<i>N</i>^2'^)bis(thiocyanato- κ<i>S</i>)platinum(II) |
|---|---|
| Formula | C12 H9 N5 Pt S2 |
| Calculated formula | C12 H9 N5 Pt S2 |
| SMILES | [Pt]1([n]2c(Nc3[n]1cccc3)cccc2)(SC#N)SC#N |
| Title of publication | <i>cis</i>-(Di-2-pyridylamine-κ^2^<i>N</i>^2^,<i>N</i>^2'^)bis(thiocyanato-κ<i>S</i>)platinum(II) |
| Authors of publication | Ha, Kwang |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 4 |
| Pages of publication | m440 |
| a | 7.2282 ± 0.0006 Å |
| b | 9.8308 ± 0.0008 Å |
| c | 10.2501 ± 0.0008 Å |
| α | 94.292 ± 0.002° |
| β | 93.081 ± 0.002° |
| γ | 106.123 ± 0.002° |
| Cell volume | 695.64 ± 0.1 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0392 |
| Residual factor for significantly intense reflections | 0.0313 |
| Weighted residual factors for significantly intense reflections | 0.0706 |
| Weighted residual factors for all reflections included in the refinement | 0.088 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.218 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181266 (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 2/23/44. |
2234426.cif 2234426.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. |
2234426.cif 2234426.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2234426.cif 2234426.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2234426.cif 2234426.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2234426.cif 2234426.hkl |
| 55703 | 2012-05-05 | cif/ Adding structures of 2234426 via cif-deposit CGI script. |
2234426.cif |
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Users of the data should acknowledge the original authors of the
structural data.