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Information card for entry 4308934
Preview
| Coordinates | 4308934.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C3 H3 Cu I N3 S3 |
|---|---|
| Calculated formula | C3 H3 Cu I N3 S3 |
| Title of publication | Coordination Polymers of Copper(I) Halides and Neutral Heterocyclic Thiones with New Coordination Modes |
| Authors of publication | Dan Li; Wen-Juan Shi; Lei Hou |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 3907 - 3913 |
| a | 12.0266 ± 0.0004 Å |
| b | 12.0266 ± 0.0004 Å |
| c | 12.0266 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1739.52 ± 0.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 205 |
| Hermann-Mauguin space group symbol | P a -3 |
| Hall space group symbol | -P 2ac 2ab 3 |
| Residual factor for all reflections | 0.0865 |
| Residual factor for significantly intense reflections | 0.0836 |
| Weighted residual factors for significantly intense reflections | 0.188 |
| Weighted residual factors for all reflections included in the refinement | 0.1894 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.314 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.