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Information card for entry 2205137
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| Coordinates | 2205137.cif |
|---|---|
| Structure factors | 2205137.hkl |
| Original IUCr paper | HTML |
| Chemical name | Nitrato[1-(2-pyridylmethyliminomethyl)naphthalen-2-olato]zinc(II) |
|---|---|
| Formula | C17 H13 N3 O4 Zn |
| Calculated formula | C17 H13 N3 O4 Zn |
| SMILES | [Zn]12([N](=Cc3c(O1)ccc1ccccc31)Cc1[n]2cccc1)ON(=O)=O |
| Title of publication | Nitrato[1-(2-pyridylmethyliminomethyl)naphthalen-2-olato]zinc(II) |
| Authors of publication | Yang, De-Suo |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 2 |
| Pages of publication | m247 - m248 |
| a | 15.105 ± 0.002 Å |
| b | 7.398 ± 0.002 Å |
| c | 15.056 ± 0.002 Å |
| α | 90° |
| β | 112.72 ± 0.01° |
| γ | 90° |
| Cell volume | 1551.9 ± 0.5 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0464 |
| Residual factor for significantly intense reflections | 0.039 |
| Weighted residual factors for significantly intense reflections | 0.1086 |
| Weighted residual factors for all reflections included in the refinement | 0.1137 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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