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Information card for entry 4103255
Preview
| Coordinates | 4103255.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H61 Ce Cl N4 O Si6 |
|---|---|
| Calculated formula | C26 H61 Ce Cl N4 O Si6 |
| SMILES | [Ce](Cl)(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)[N]#Cc1ccc(OC)cc1 |
| Title of publication | Facile Access to Tetravalent Cerium Compounds: One-Electron Oxidation Using Iodine(III) Reagents |
| Authors of publication | Peter Dröse; Alan R. Crozier; Samira Lashkari; Jochen Gottfriedsen; Steffen Blaurock; Cristian G. Hrib; Cäcilia Maichle-Mössmer; Christoph Schädle; Reiner Anwander; Frank T. Edelmann |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2010 |
| Journal volume | 132 |
| Pages of publication | 14046 - 14047 |
| a | 11.861 ± 0.002 Å |
| b | 19.126 ± 0.004 Å |
| c | 18.467 ± 0.004 Å |
| α | 90° |
| β | 94.46 ± 0.03° |
| γ | 90° |
| Cell volume | 4176.6 ± 1.5 Å3 |
| Cell temperature | 143 ± 2 K |
| Ambient diffraction temperature | 143 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0381 |
| Residual factor for significantly intense reflections | 0.0319 |
| Weighted residual factors for significantly intense reflections | 0.0722 |
| Weighted residual factors for all reflections included in the refinement | 0.0744 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.131 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178778 (current) | 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 4/10/32. |
4103255.cif |
| 120076 | 2014-07-11 | Adding DOIs to range 4/10 structures. | 4103255.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4103255.cif |
| 26214 | 2011-09-19 | ../uploads/cif-deposit/cod/cif Adding structures of 4103255 via cif-deposit CGI script. |
4103255.cif |
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Users of the data should acknowledge the original authors of the
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