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Information card for entry 7011740
Preview
| Coordinates | 7011740.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | aw0123 |
|---|---|
| Formula | C30 H35 Li N4 O Zn |
| Calculated formula | C30 H35 Li N4 O Zn |
| SMILES | [Zn]12([N](c3cccc[n]43)(c3ccccc3)[Li]4([O]3CCCC3)[N]1(c1[n]2cccc1)c1ccccc1)C(C)(C)C |
| Title of publication | Oxygen scavenging by lithium zincates: the synthesis, structural characterisation and derivatisation of [Ph(2-C5H4N)N]2ZnRLi??nthf (R = But, Bun; n = 1, 2) |
| Authors of publication | Boss, Sally R.; Haigh, Robert; Linton, David J.; Wheatley, Andrew E. H. |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2002 |
| Journal issue | 16 |
| Pages of publication | 3129 |
| a | 9.6358 ± 0.0005 Å |
| b | 17.4699 ± 0.0009 Å |
| c | 16.9408 ± 0.0005 Å |
| α | 90° |
| β | 93.23 ± 0.003° |
| γ | 90° |
| Cell volume | 2847.2 ± 0.2 Å3 |
| Cell temperature | 220 ± 2 K |
| Ambient diffraction temperature | 220 ± 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 | 0.093 |
| Residual factor for significantly intense reflections | 0.0597 |
| Weighted residual factors for significantly intense reflections | 0.1198 |
| Weighted residual factors for all reflections included in the refinement | 0.1309 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.71069 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. |
7011740.cif |
| 179821 | 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 7/01/17. |
7011740.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7011740.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7011740.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7011740.cif |
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