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Information card for entry 7010424
Preview
| Coordinates | 7010424.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H58 N4 O8 Rb2 Si2 |
|---|---|
| Calculated formula | C32 H58 N4 O8 Rb2 Si2 |
| SMILES | [Rb]12345([n]67ccccc6[N]1([Si](C)(C)C)[Rb]1687([n]74c([N]51[Si](C)(C)C)cccc7)[O]1CCOCC[O]6CC[O]8CC1)[O]1CCOCC[O]2CC[O]3CC1 |
| Title of publication | Cation-induced structural variations in the alkali metal derivatives of 2-trimethylsilylaminopyridine: synthesis and X-ray structures of complexes for all five metals Li‒Cs with 12-crown-4 † |
| Authors of publication | Liddle, Stephen T.; Clegg, William |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2001 |
| Journal issue | 4 |
| Pages of publication | 402 |
| a | 9.8861 ± 0.0015 Å |
| b | 10.0654 ± 0.0015 Å |
| c | 11.9755 ± 0.0017 Å |
| α | 106.949 ± 0.002° |
| β | 108.155 ± 0.002° |
| γ | 91.402 ± 0.002° |
| Cell volume | 1074.4 ± 0.3 Å3 |
| Cell temperature | 160 ± 2 K |
| Ambient diffraction temperature | 160 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0658 |
| Residual factor for significantly intense reflections | 0.0534 |
| Weighted residual factors for significantly intense reflections | 0.1289 |
| Weighted residual factors for all reflections included in the refinement | 0.1318 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.947 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213973 (current) | 2019-03-05 | cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries. |
7010424.cif |
| 179808 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/04. |
7010424.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7010424.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7010424.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7010424.cif |
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Users of the data should acknowledge the original authors of the
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