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Information card for entry 7013145
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| Coordinates | 7013145.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | (Co(EtN4S2amp))Cl(ClO4)2 |
|---|---|
| Formula | C12 H30 Cl3 Co N4 O8 S2 |
| Calculated formula | C12 H30 Cl3 Co N4 O8 S2 |
| SMILES | C12(C[NH2][Co]345([NH2]CC(C)(C[NH2]4)C[S]5CC[S]3C1)[NH2]C2)C.[O-]Cl(=O)(=O)=O.[Cl-].[O-]Cl(=O)(=O)=O |
| Title of publication | Embracing ligands. A synthetic strategy towards new nitrogen‒thioether multidentate ligands and characterization of the cobalt(III) complexes |
| Authors of publication | Clint A. Sharrad; Stefan R. Lüthi; Lawrence R. Gahan |
| Journal of publication | Dalton Trans. |
| Year of publication | 2003 |
| Journal issue | 19 |
| Pages of publication | 3693 - 3703 |
| a | 7.6249 ± 0.0005 Å |
| b | 16.779 ± 0.003 Å |
| c | 17.683 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2262.3 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.0813 |
| Residual factor for significantly intense reflections | 0.0471 |
| Weighted residual factors for all reflections | 0.1449 |
| Weighted residual factors for significantly intense reflections | 0.1266 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179835 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/31. |
7013145.cif |
| 132627 | 2015-03-03 | cif/ (antanas@koala.ibt.lt) Removing unrecognised tags from CIFs in range 4/ and range 7/. |
7013145.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7013145.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7013145.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7013145.cif |
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