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Information card for entry 4338676
Preview
| Coordinates | 4338676.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C129 H156 Si6 |
|---|---|
| Calculated formula | C129 H156 Si6 |
| Title of publication | Isolable 1,1-disubstituted silole dianion: a homogeneous two-electron-transfer reducing reagent. |
| Authors of publication | Han, Zhengang; Li, Jianfeng; Hu, Hongfan; Zhang, Jianying; Cui, Chunming |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 12 |
| Pages of publication | 5890 - 5892 |
| a | 11.813 ± 0.002 Å |
| b | 15.658 ± 0.003 Å |
| c | 16.713 ± 0.003 Å |
| α | 84.56 ± 0.03° |
| β | 79.12 ± 0.03° |
| γ | 81.76 ± 0.03° |
| Cell volume | 2997.2 ± 1 Å3 |
| Cell temperature | 113.15 K |
| Ambient diffraction temperature | 113.15 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1437 |
| Residual factor for significantly intense reflections | 0.0789 |
| Weighted residual factors for significantly intense reflections | 0.1976 |
| Weighted residual factors for all reflections included in the refinement | 0.241 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.959 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301839 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure. |
4338676.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4338676.cif |
| 119112 | 2014-07-05 | cif/ Updating files of 4338675, 4338676 Original log message: Adding full bibliography for 4338675--4338676.cif. |
4338676.cif |
| 114971 | 2014-05-31 | cif/ Adding structures of 4338675, 4338676 via cif-deposit CGI script. |
4338676.cif |
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Users of the data should acknowledge the original authors of the
structural data.