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Information card for entry 2224474
Preview
| Coordinates | 2224474.cif |
|---|---|
| Structure factors | 2224474.hkl |
| Original IUCr paper | HTML |
| Chemical name | Dichlorido[<i>N</i>'-(3,5-dichloro-2-hydroxybenzylidene)pyridine-4- carbohydrazide-κ<i>N</i>](1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')cobalt(II) methanol monosolvate |
|---|---|
| Formula | C39 H30 Cl6 Co N8 O5 |
| Calculated formula | C39 H30 Cl6 Co N8 O5 |
| SMILES | [Co]1(Cl)(Cl)([n]2ccc(C(=O)N/N=C/c3c(O)c(Cl)cc(Cl)c3)cc2)([n]2ccc(C(=O)N/N=C/c3c(O)c(Cl)cc(Cl)c3)cc2)[n]2cccc3c2c2[n]1cccc2cc3.OC |
| Title of publication | Dichlorido[<i>N</i>'-(3,5-dichloro-2-hydroxybenzylidene)pyridine-4-carbohydrazide-κ<i>N</i>](1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II) methanol monosolvate |
| Authors of publication | Wang, Yuan; Liu, Zheng; Liu, Baoyu |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2009 |
| Journal volume | 65 |
| Journal issue | 12 |
| Pages of publication | m1594 |
| a | 20.797 ± 0.003 Å |
| b | 14.1641 ± 0.0016 Å |
| c | 13.7952 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4063.7 ± 0.8 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.119 |
| Residual factor for significantly intense reflections | 0.056 |
| Weighted residual factors for significantly intense reflections | 0.1338 |
| Weighted residual factors for all reflections included in the refinement | 0.1701 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2224474.html
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