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Information card for entry 7113675
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| Coordinates | 7113675.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | L2Li4 |
|---|---|
| Formula | C40 H52 Li4 N8 O2 |
| Calculated formula | C40 H52 Li4 N8 O2 |
| SMILES | [O]123c4c5[N]67[Li]8([N](C)(C)CC6)[O]69[Li]%10%11[N](CC[N]%10(C)C)(c%10c1c(ccc%10)c4ccc5)[Li]12[N](C)(C)CC[N]81c1cccc(c61)c1c9c([N]2%11[Li]37[N](CC2)(C)C)ccc1 |
| Title of publication | New dibenzofuran-bridged bis(amidoamine) and bis(ethylenediamine) ligands and their dinuclear zinc and aluminium complexes |
| Authors of publication | Hlavinka, Mark L.; Hagadorn, John R. |
| Journal of publication | Chemical Communications (Cambridge, United Kingdom) |
| Year of publication | 2003 |
| Journal issue | 21 |
| Pages of publication | 2686 - 2687 |
| a | 10.6476 ± 0.0003 Å |
| b | 21.3387 ± 0.0006 Å |
| c | 17.4505 ± 0.0005 Å |
| α | 90° |
| β | 94.41 ± 0.001° |
| γ | 90° |
| Cell volume | 3953.12 ± 0.19 Å3 |
| Cell temperature | 142 ± 2 K |
| Ambient diffraction temperature | 142 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0955 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for significantly intense reflections | 0.1266 |
| Weighted residual factors for all reflections included in the refinement | 0.1466 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Duplicate of | 7104881 |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 210662 (current) | 2018-09-09 | cif/7/ Updating bibliography in entries 7104880-7104882, 7113674-7113676. Marking entries 7113674-7113676 as duplicates of entries 7104880-7104882. |
7113675.cif |
| 180250 | 2016-03-26 | cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/36. |
7113675.cif |
| 115199 | 2014-06-02 | cif/ Adding structures of 7113674, 7113675, 7113676 via cif-deposit CGI script. |
7113675.cif |
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Users of the data should acknowledge the original authors of the
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