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Information card for entry 2007017
Preview
| Coordinates | 2007017.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Aqua(2,3-dimethylpyridine)(N-salicylideneglycinato)copper(II) |
|---|---|
| Formula | C16 H18 Cu N2 O4 |
| Calculated formula | C16 H18 Cu N2 O4 |
| SMILES | [Cu]12([OH2])(Oc3ccccc3C=[N]1CC(=O)O2)[n]1c(c(ccc1)C)C |
| Title of publication | Aqua(2,3-dimethylpyridine-<i>N</i>)(<i>N</i>-salicylideneglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II) |
| Authors of publication | Warda, Salam A. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 2 |
| Pages of publication | 187 - 189 |
| a | 6.9449 ± 0.0007 Å |
| b | 10.3618 ± 0.0013 Å |
| c | 11.9715 ± 0.0014 Å |
| α | 75.392 ± 0.011° |
| β | 88.293 ± 0.01° |
| γ | 70.621 ± 0.009° |
| Cell volume | 785.04 ± 0.17 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0598 |
| Residual factor for significantly intense reflections | 0.0488 |
| Weighted residual factors for all reflections included in the refinement | 0.1399 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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