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Information card for entry 1517864
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| Coordinates | 1517864.cif |
|---|
| Formula | C10 H18 Cr N2 O4 S2 Tl |
|---|---|
| Calculated formula | C10 Cr N2 O4 S2 Tl |
| SMILES | [Tl+].[Cr]1234(SC([C@@H]([NH2]3)C(=O)O1)(C)C)SC([C@@H]([NH2]4)C(=O)O2)(C)C |
| Title of publication | Penicillamine complexes of nickel, chromium, and molybdenum - structural particularity and biological/medical relevance |
| Authors of publication | Muller, A.; Johannes, K. U.; Straube, M.; Krickemeyer, R.; Bogge, H. |
| Journal of publication | Zeitschrift fuer Anorganische und Allgemeine Chemie |
| Year of publication | 1993 |
| Journal volume | 619 |
| Pages of publication | 1037 - 1046 |
| a | 20.54 ± 0.003 Å |
| b | 5.921 ± 0.001 Å |
| c | 6.067 ± 0.001 Å |
| α | 90° |
| β | 92.89 ± 0.01° |
| γ | 90° |
| Cell volume | 736.9 ± 0.2 Å3 |
| Number of distinct elements | 7 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for significantly intense reflections | 0.028 |
| Weighted residual factors for significantly intense reflections | 0.033 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1517864.cif |
| 124438 | 2014-09-30 | cif/ Adding structures of 1517864 via cif-deposit CGI script. |
1517864.cif |
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Users of the data should acknowledge the original authors of the
structural data.