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Information card for entry 2006265
Preview
| Coordinates | 2006265.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C23 H23 N3 O2 |
|---|---|
| Calculated formula | C23 H23 N3 O2 |
| SMILES | COc1ccc(cc1)/N=C(/c1cccc(n1)/C(=N/c1ccc(cc1)OC)C)C |
| Title of publication | 2,6-Diacetylpyridinebis(<i>p</i>-methoxyaniline), a Terdentate <i>NNN</i> Donor Ligand |
| Authors of publication | Meehan, Paul R.; Alyea, Elmer C.; Ferguson, George |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1997 |
| Journal volume | 53 |
| Journal issue | 7 |
| Pages of publication | 888 - 890 |
| a | 40.266 ± 0.014 Å |
| b | 7.044 ± 0.0013 Å |
| c | 7.1203 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2019.6 ± 0.9 Å3 |
| Cell temperature | 294 ± 1 K |
| Ambient diffraction temperature | 294 ± 1 K |
| Number of distinct elements | 4 |
| Space group number | 36 |
| Hermann-Mauguin space group symbol | C m c 21 |
| Hall space group symbol | C 2c -2 |
| Residual factor for all reflections | 0.0973 |
| Residual factor for significantly intense reflections | 0.052 |
| Weighted residual factors for all reflections | 0.1436 |
| Weighted residual factors for significantly intense reflections | 0.127 |
| Goodness-of-fit parameter for all reflections | 0.94 |
| Goodness-of-fit parameter for significantly intense reflections | 1.14 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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