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Information card for entry 4301080
Preview
| Coordinates | 4301080.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C62 H60 Cl12 N4 S4 Zn2 |
|---|---|
| Calculated formula | C62 H60 Cl12 N4 S4 Zn2 |
| Title of publication | Synthesis and Coordination Properties of Chelating Dithiophenolate Ligands |
| Authors of publication | Joachim Ballmann; Michael G. G. Fuchs; Sebastian Dechert; Michael John; Franc Meyer |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2009 |
| Journal volume | 48 |
| Pages of publication | 90 - 99 |
| a | 17.7471 ± 0.0006 Å |
| b | 11.0026 ± 0.0002 Å |
| c | 18.2732 ± 0.0007 Å |
| α | 90° |
| β | 112.274 ± 0.003° |
| γ | 90° |
| Cell volume | 3301.86 ± 0.19 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0547 |
| Residual factor for significantly intense reflections | 0.0373 |
| Weighted residual factors for significantly intense reflections | 0.0784 |
| Weighted residual factors for all reflections included in the refinement | 0.0831 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.