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Information card for entry 2023353
Preview
| Coordinates | 2023353.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Diiodidobis(isoquinoline <i>N</i>-oxide-κ<i>O</i>)zinc(II) |
|---|---|
| Formula | C18 H14 I2 N2 O2 Zn |
| Calculated formula | C18 H14 I2 N2 O2 Zn |
| Title of publication | Crystal structures of zinc(II) coordination complexes with isoquinoline N-oxide |
| Authors of publication | Groneck, Erin N.; Peek, Nathan; Lynch, Will E.; Padgett, Clifford W. |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2025 |
| Journal volume | 81 |
| Journal issue | 2 |
| a | 7.7325 ± 0.0003 Å |
| b | 8.9596 ± 0.0004 Å |
| c | 14.8297 ± 0.0009 Å |
| α | 93.205 ± 0.004° |
| β | 99.873 ± 0.004° |
| γ | 104.852 ± 0.004° |
| Cell volume | 972.98 ± 0.09 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0248 |
| Residual factor for significantly intense reflections | 0.0201 |
| Weighted residual factors for significantly intense reflections | 0.0463 |
| Weighted residual factors for all reflections included in the refinement | 0.0481 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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