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Information card for entry 4107595
Preview
| Coordinates | 4107595.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | Chlorodiphenylsilyldisilene |
|---|---|
| Chemical name | 1-Chloro(diphenyl)silyl-1,2,2-tris(2',4',6'-triisopropylphenyl)disilene |
| Formula | C233 H328 Cl4 Si12 |
| Calculated formula | C233 H328 Cl4 Si12 |
| Title of publication | Syntheses of Trisila Analogues of Allyl Chlorides and Their Transformations to Chlorocyclotrisilanes, Cyclotrisilanides, and a Trisilaindane |
| Authors of publication | Kai Abersfelder; David Scheschkewitz |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2008 |
| Journal volume | 130 |
| Pages of publication | 4114 - 4121 |
| a | 31.0675 ± 0.0008 Å |
| b | 18.4074 ± 0.0005 Å |
| c | 39.2606 ± 0.0009 Å |
| α | 90° |
| β | 99.287 ± 0.001° |
| γ | 90° |
| Cell volume | 22157.7 ± 1 Å3 |
| Cell temperature | 98 ± 2 K |
| Ambient diffraction temperature | 98 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.072 |
| Residual factor for significantly intense reflections | 0.0508 |
| Weighted residual factors for significantly intense reflections | 0.1226 |
| Weighted residual factors for all reflections included in the refinement | 0.1376 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301832 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/10/ Each referenced PubChem compound corresponds to the full crystal structure. |
4107595.cif |
| 178821 | 2016-03-21 | cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/75. |
4107595.cif |
| 120076 | 2014-07-11 | Adding DOIs to range 4/10 structures. | 4107595.cif |
| 55281 | 2012-05-04 | cif/ Adding structures of 4107595 via cif-deposit CGI script. |
4107595.cif |
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Users of the data should acknowledge the original authors of the
structural data.