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Information card for entry 2214385
Preview
| Coordinates | 2214385.cif |
|---|---|
| Structure factors | 2214385.hkl |
| Original IUCr paper | HTML |
| External links | PubChem |
| Chemical name | Bis(dimethylformamide-2κO)bis[μ-1-(2-oxidobenzoyl)-2- (phenoxyacetyl)hydrazine(3-)]- 1κ^3^O,N,O':2κ^2^N,O'';2κ^2^N,O'':3κ^3^O,N,O'-dipyridine-1κN,3κN- trinickel(II) |
|---|---|
| Formula | C46 H46 N8 Ni3 O10 |
| Calculated formula | C46 H46 N8 Ni3 O10 |
| SMILES | c12c(cccc1)C1=[N]3[N](=C(COc4ccccc4)O[Ni]3([n]3ccccc3)O2)[Ni]2(O1)([O]=CN(C)C)([N]1=C(COc3ccccc3)O[Ni]3([N]1=C(c1c(cccc1)O3)O2)[n]1ccccc1)[O]=CN(C)C |
| Title of publication | Bis(dimethylformamide-2κ<i>O</i>)bis[μ-1-(2-oxidobenzoyl)-2-(phenoxyacetyl)hydrazine(3{-})]-1κ^3^<i>O</i>,<i>N</i>,<i>O</i>':2κ^2^<i>N</i>,<i>O</i>'';2κ^2^<i>N</i>,<i>O</i>'':3κ^3^<i>O</i>,<i>N</i>,<i>O</i>'-dipyridine-1κ<i>N</i>,3κ<i>N</i>-trinickel(II) |
| Authors of publication | Zhao, Yan; Luo, Jian-Hai; Huang, Xi-He; Huang, Chang-Cang; Liu, Dong-Sheng |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2007 |
| Journal volume | 63 |
| Journal issue | 7 |
| Pages of publication | m1999 - m2000 |
| a | 28.646 ± 0.006 Å |
| b | 8.249 ± 0.0016 Å |
| c | 21.176 ± 0.004 Å |
| α | 90° |
| β | 112.98 ± 0.03° |
| γ | 90° |
| Cell volume | 4606.8 ± 1.9 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 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 | 0.1091 |
| Residual factor for significantly intense reflections | 0.06 |
| Weighted residual factors for significantly intense reflections | 0.1098 |
| Weighted residual factors for all reflections included in the refinement | 0.1291 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
| 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/2214385.html
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