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Information card for entry 2018917
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| Coordinates | 2018917.cif |
|---|---|
| Structure factors | 2018917.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>cis</i>-amminedibromido(2-methylpyridine-κ<i>N</i>)platinum(II) |
|---|---|
| Formula | C6 H10 Br2 N2 Pt |
| Calculated formula | C6 H10 Br2 N2 Pt |
| SMILES | c1[n]([Pt]([NH3])(Br)Br)c(ccc1)C |
| Title of publication | A bromine analogue of picoplatin: a new substance from the group of platinum-based chemotherapeutics |
| Authors of publication | Pažout, Richard; Maixner, Jaroslav; Hrdá, Michaela; Loužilová, Tereza; Kačer, Petr |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 4 |
| Pages of publication | 337 - 339 |
| a | 10.0371 ± 0.0003 Å |
| b | 9.0733 ± 0.0003 Å |
| c | 11.4901 ± 0.0004 Å |
| α | 90° |
| β | 102.12 ± 0.003° |
| γ | 90° |
| Cell volume | 1023.07 ± 0.06 Å3 |
| Cell temperature | 190 K |
| Ambient diffraction temperature | 190 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0366 |
| Residual factor for significantly intense reflections | 0.0303 |
| Weighted residual factors for significantly intense reflections | 0.0347 |
| Weighted residual factors for all reflections included in the refinement | 0.0357 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.69 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180858 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/89. |
2018917.cif 2018917.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2018917.cif 2018917.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. |
2018917.cif 2018917.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2018917.cif 2018917.hkl |
| 85415 | 2013-05-07 | cif/ Adding structures of 2018917 via cif-deposit CGI script. |
2018917.cif |
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Users of the data should acknowledge the original authors of the
structural data.