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Information card for entry 4085243
Preview
| Coordinates | 4085243.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H96 Li6 N6 Si6 |
|---|---|
| Calculated formula | C36 H96 Li6 N6 Si6 |
| SMILES | [Si]([NH]12[Li]3[NH]4([Si](C)(C)C(C)(C)C)[Li]5[NH]3([Si](C)(C)C(C)(C)C)[Li]1[NH]1([Si](C)(C)C(C)(C)C)[Li]3[NH]5([Si](C)(C)C(C)(C)C)[Li]4[NH]3([Si](C)(C)C(C)(C)C)[Li]21)(C)(C)C(C)(C)C |
| Title of publication | Homoleptic Trigonal Planar Lanthanide Complexes Stabilized by Superbulky Silylamide Ligands |
| Authors of publication | Goodwin, Conrad A. P.; Joslin, Kristian C.; Lockyer, Selena J.; Formanuik, Alasdair; Morris, Gareth A.; Ortu, Fabrizio; Vitorica-Yrezabal, Iñigo. J.; Mills, David P. |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 11 |
| Pages of publication | 2314 |
| a | 12.3694 ± 0.0011 Å |
| b | 19.5146 ± 0.001 Å |
| c | 13.2445 ± 0.0011 Å |
| α | 90° |
| β | 117.52 ± 0.011° |
| γ | 90° |
| Cell volume | 2835.3 ± 0.5 Å3 |
| Cell temperature | 100.3 ± 0.5 K |
| Ambient diffraction temperature | 100.3 ± 0.5 K |
| Number of distinct elements | 5 |
| 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 | 0.0649 |
| Residual factor for significantly intense reflections | 0.0479 |
| Weighted residual factors for significantly intense reflections | 0.1172 |
| Weighted residual factors for all reflections included in the refinement | 0.1308 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301831 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/08/ Each referenced PubChem compound corresponds to the full crystal structure. |
4085243.cif |
| 178741 | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/52. |
4085243.cif |
| 140241 | 2015-07-05 | cif/ Updating files of 4085243, 4085244, 4085245, 4085246, 4085247, 4085248, 4085249, 4085250, 4085251, 4085252, 4085253, 4085254 Original log message: Adding full bibliography for 4085243--4085254.cif. |
4085243.cif |
| 129939 | 2015-01-17 | cif/ Adding structures of 4085243, 4085244, 4085245, 4085246, 4085247, 4085248, 4085249, 4085250, 4085251, 4085252, 4085253, 4085254 via cif-deposit CGI script. |
4085243.cif |
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Users of the data should acknowledge the original authors of the
structural data.