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Information card for entry 4075802
Preview
| Coordinates | 4075802.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 7 |
|---|---|
| Chemical name | Cyclohexyl-bis[N-(dimethylamino)trifluoroacetimidato-N,O]siliconium triflate |
| Formula | C15 H23 F9 N4 O5 S Si |
| Calculated formula | C15 H23 F9 N4 O5 S Si |
| SMILES | [Si]12(OC(=N[N]1(C)C)C(F)(F)F)(OC(=N[N]2(C)C)C(F)(F)F)C1CCCCC1.S(=O)(=O)([O-])C(F)(F)F |
| 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 | 18.726 ± 0.003 Å |
| b | 8.0215 ± 0.0013 Å |
| c | 15.525 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2332 ± 0.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.0315 |
| Residual factor for significantly intense reflections | 0.0307 |
| Weighted residual factors for significantly intense reflections | 0.0767 |
| Weighted residual factors for all reflections included in the refinement | 0.0772 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| 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. |
4075802.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4075802.cif |
| 50673 | 2012-03-31 | ../uploads/cif-deposit/cod/cif Adding structures of 4075801, 4075802, 4075803 via cif-deposit CGI script. |
4075802.cif |
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Users of the data should acknowledge the original authors of the
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