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Information card for entry 1512889
Preview
| Coordinates | 1512889.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C42 H38 Cl6 Co F6 N4 O4 P |
|---|---|
| Calculated formula | C42 H38 Cl6 Co F6 N4 O4 P |
| SMILES | [P](F)(F)(F)(F)(F)[F-].[Co]123(Oc4cc(OC)ccc4C=[N]1[C@@H]([C@H](c1ccccc1)[N]2=Cc1ccc(OC)cc1O3)c1ccccc1)([n]1ccccc1)[n]1ccccc1.ClC(Cl)Cl.ClC(Cl)Cl |
| Title of publication | Cobalt(III) Schiff base complexes derived from mesostilbenediamine: Synthesis, characterization, crystal structure, electrochemistry and antibacterial studies |
| Authors of publication | Hasti Iranmanesh; Mahdi Behzad; Giuseppe Bruno; Hadi Amiri Rudbari; Hossein Nazari; Abolfazl Mohammadi; Omid Taheri |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2013 |
| Journal volume | 395 |
| Pages of publication | 81 - 88 |
| a | 11.5134 ± 0.0002 Å |
| b | 17.7255 ± 0.0003 Å |
| c | 23.1828 ± 0.0003 Å |
| α | 90° |
| β | 96.341 ± 0.001° |
| γ | 90° |
| Cell volume | 4702.22 ± 0.13 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.039 |
| Residual factor for significantly intense reflections | 0.0368 |
| Weighted residual factors for significantly intense reflections | 0.1019 |
| Weighted residual factors for all reflections included in the refinement | 0.1039 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301776 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/51 Each referenced PubChem compound corresponds to the full crystal structure. |
1512889.cif |
| 176729 | 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. |
1512889.cif |
| 120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1512889.cif |
| 91050 | 2013-12-03 | cif/ Adding structures of 1512889 via cif-deposit CGI script. |
1512889.cif |
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