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Information card for entry 1551531
Preview
| Coordinates | 1551531.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H18 N4 O2 Zn |
|---|---|
| Calculated formula | C18 H18 N4 O2 Zn |
| SMILES | [Zn]12(Oc3ccccc3C3NCC[N]1=3)Oc1ccccc1C1NCC[N]2=1 |
| Title of publication | Synthesis and Crystal Structure of Bis[2-(2-imidazolinyl)phenolato]zinc(II) |
| Authors of publication | MITSUHASHI, Ryoji; MIKURIYA, Masahiro |
| Journal of publication | X-ray Structure Analysis Online |
| Year of publication | 2019 |
| Journal volume | 35 |
| Journal issue | 0 |
| Pages of publication | 15 |
| a | 12.0318 ± 0.0015 Å |
| b | 7.6706 ± 0.001 Å |
| c | 18.617 ± 0.002 Å |
| α | 90° |
| β | 105.089 ± 0.002° |
| γ | 90° |
| Cell volume | 1658.9 ± 0.3 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0712 |
| Residual factor for significantly intense reflections | 0.0454 |
| Weighted residual factors for significantly intense reflections | 0.098 |
| Weighted residual factors for all reflections included in the refinement | 0.1096 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216141 (current) | 2019-06-20 | cif/ Adding structures of 1551531 via cif-deposit CGI script. |
1551531.cif |
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Users of the data should acknowledge the original authors of the
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