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Information card for entry 2234565
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| Coordinates | 2234565.cif |
|---|---|
| Structure factors | 2234565.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis{2-amino-2-oxo-<i>N</i>-[(1<i>E</i>)-1-(pyridin-2- yl-κ<i>N</i>)ethylidene]acetohydrazidato-κ^2^<i>N</i>',<i>O</i>^1^}nickel(II) |
|---|---|
| Formula | C18 H18 N8 Ni O4 |
| Calculated formula | C18 H18 N8 Ni O4 |
| SMILES | c1cccc2C(C)=[N]3N=C(C(=O)N)O[Ni]453([n]12)[n]1ccccc1C(C)=[N]4N=C(C(=O)N)O5 |
| Title of publication | Bis{2-amino-2-oxo-<i>N</i>-[(1<i>E</i>)-1-(pyridin-2-yl-κ<i>N</i>)ethylidene]acetohydrazidato-κ^2^<i>N</i>',<i>O</i>^1^}nickel(II) |
| Authors of publication | Kane, Cheikh Hamidou; Thiam, Ibrahima Elhadj; Tamboura, Farba Bouyagui; Gaye, Mohamed; Retailleau, Pascal |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 5 |
| Pages of publication | m553 |
| a | 16.703 ± 0.003 Å |
| b | 17.878 ± 0.004 Å |
| c | 8.929 ± 0.002 Å |
| α | 90° |
| β | 114.915 ± 0.005° |
| γ | 90° |
| Cell volume | 2418.2 ± 0.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.084 |
| Residual factor for significantly intense reflections | 0.051 |
| Weighted residual factors for significantly intense reflections | 0.1216 |
| Weighted residual factors for all reflections included in the refinement | 0.1371 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181267 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/45. |
2234565.cif 2234565.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2234565.cif 2234565.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2234565.cif 2234565.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2234565.cif 2234565.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2234565.cif 2234565.hkl |
| 60036 | 2012-06-14 | cif/ Adding structures of 2234565 via cif-deposit CGI script. |
2234565.cif |
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Users of the data should acknowledge the original authors of the
structural data.