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Information card for entry 4075801
Preview
| Coordinates | 4075801.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 6 |
|---|---|
| Chemical name | Cyclohexyl-bis[N-(dimethylamino)pivaloimidato-N,O]siliconium chloride |
| Formula | C23 H44 Cl10 N4 O2 Si |
| Calculated formula | C23 H44 Cl10 N4 O2 Si |
| SMILES | [Si]12(OC(=N[N]1(C)C)C(C)(C)C)(OC(=N[N]2(C)C)C(C)(C)C)C1CCCCC1.[Cl-].C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl |
| Title of publication | Donor-Stabilized Silyl Cations. 9. Two Dissociation Patterns of Hexacoordinate Silicon Complexes: A Model Nucleophilic Substitution at Pentacoordinate Silicon1 |
| Authors of publication | Gostevskii, Boris; Silbert, Gilad; Adear, Keren; Sivaramakrishna, Akella; Stalke, Dietmar; Deuerlein, Stephan; Kocher, Nikolaus; Voronkov, Mikhail G.; Kalikhman, Inna; Kost, Daniel |
| Journal of publication | Organometallics |
| Year of publication | 2005 |
| Journal volume | 24 |
| Journal issue | 12 |
| Pages of publication | 2913 |
| a | 18.6709 ± 0.0011 Å |
| b | 10.0493 ± 0.0006 Å |
| c | 20.2826 ± 0.0012 Å |
| α | 90° |
| β | 100.508 ± 0.001° |
| γ | 90° |
| Cell volume | 3741.8 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0579 |
| Residual factor for significantly intense reflections | 0.0529 |
| Weighted residual factors for significantly intense reflections | 0.14 |
| Weighted residual factors for all reflections included in the refinement | 0.145 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178647 (current) | 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 4/07/58. |
4075801.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4075801.cif |
| 50673 | 2012-03-31 | ../uploads/cif-deposit/cod/cif Adding structures of 4075801, 4075802, 4075803 via cif-deposit CGI script. |
4075801.cif |
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