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Information card for entry 4074232
Preview
| Coordinates | 4074232.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C14 H24 Si3 |
|---|---|
| Calculated formula | C14 H24 Si3 |
| SMILES | [SiH]([Si](C)(C)C)([Si](C)(C)C)C#Cc1ccccc1 |
| Title of publication | Cobalt-Assisted Silicon−Silicon Bond Activation |
| Authors of publication | Zirngast, Michaela; Marschner, Christoph; Baumgartner, Judith |
| Journal of publication | Organometallics |
| Year of publication | 2006 |
| Journal volume | 25 |
| Journal issue | 20 |
| Pages of publication | 4897 |
| a | 14.197 ± 0.003 Å |
| b | 6.0209 ± 0.0012 Å |
| c | 20.974 ± 0.004 Å |
| α | 90° |
| β | 95.61 ± 0.03° |
| γ | 90° |
| Cell volume | 1784.2 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| 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 | 0.0783 |
| Residual factor for significantly intense reflections | 0.0697 |
| Weighted residual factors for significantly intense reflections | 0.1749 |
| Weighted residual factors for all reflections included in the refinement | 0.1813 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.147 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301830 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/07/ Each referenced PubChem compound corresponds to the full crystal structure. |
4074232.cif |
| 178631 | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/42. |
4074232.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4074232.cif |
| 48262 | 2012-03-26 | ../uploads/cif-deposit/cod/cif Adding structures of 4074230, 4074231, 4074232, 4074233, 4074234, 4074235, 4074236, 4074237, 4074238, 4074239, 4074240, 4074241 via cif-deposit CGI script. |
4074232.cif |
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Users of the data should acknowledge the original authors of the
structural data.