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Information card for entry 4083390
Preview
| Coordinates | 4083390.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | 2,6-diisopropylbenzenamido lithium |
|---|---|
| Formula | C32 H56 Li2 N2 O2 |
| Calculated formula | C32 H56 Li2 N2 O2 |
| SMILES | [NH]1(c2c(cccc2C(C)C)C(C)C)[Li]([NH](c2c(cccc2C(C)C)C(C)C)[Li]1[O](CC)CC)[O](CC)CC |
| Title of publication | μ2,η1-N-[(N,N-Dimethylamino)dimethylsilyl]-2,6-diisopropylanilido Metal (Li, Zr, Hf) Compounds and the Catalytic Behaviors of the IVB Compounds in Ethylene (Co)Polymerizationξ |
| Authors of publication | Yuan, Shifang; Wei, Xuehong; Tong, Hongbo; Zhang, Liping; Liu, Diansheng; Sun, Wen-Hua |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 9 |
| Pages of publication | 2085 |
| a | 9.834 ± 0.002 Å |
| b | 10.759 ± 0.002 Å |
| c | 32.409 ± 0.007 Å |
| α | 90° |
| β | 94.53 ± 0.03° |
| γ | 90° |
| Cell volume | 3418.3 ± 1.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 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 significantly intense reflections | 0.1059 |
| Weighted residual factors for significantly intense reflections | 0.2321 |
| Weighted residual factors for all reflections included in the refinement | 0.2402 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.268 |
| 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. |
4083390.cif |
| 178722 | 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 4/08/33. |
4083390.cif |
| 114523 | 2014-05-24 | cif/ Adding structures of 4083390, 4083391, 4083392, 4083393, 4083394, 4083395, 4083396 via cif-deposit CGI script. |
4083390.cif |
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Users of the data should acknowledge the original authors of the
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