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Information card for entry 4085167
Preview
| Coordinates | 4085167.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41 H82 N7 Nd Si4 |
|---|---|
| Calculated formula | C41 H82 N7 Nd Si4 |
| SMILES | c1(ccc(C)n1CCN(CCn1c(ccc1C)C)C1=[N](C2CCCCC2)[Nd](N1C1CCCCC1)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C |
| Title of publication | Synthesis, Characterization, and Reactivity of Lanthanide Amides Incorporating Neutral Pyrrole Ligand. Isolation and Characterization of Active Catalyst for Cyanosilylation of Ketones |
| Authors of publication | Wang, Fenhua; Wei, Yun; Wang, Shaowu; Zhu, Xiancui; Zhou, Shuangliu; Yang, Gaosheng; Gu, Xiaoxia; Zhang, Guangchao; Mu, Xiaolong |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 1 |
| Pages of publication | 86 |
| a | 19.8599 ± 0.0014 Å |
| b | 11.7925 ± 0.0008 Å |
| c | 24.0745 ± 0.0017 Å |
| α | 90° |
| β | 112.941 ± 0.001° |
| γ | 90° |
| Cell volume | 5192.3 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0483 |
| Residual factor for significantly intense reflections | 0.0318 |
| Weighted residual factors for significantly intense reflections | 0.0716 |
| Weighted residual factors for all reflections included in the refinement | 0.0783 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178740 (current) | 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 4/08/51. |
4085167.cif |
| 130799 | 2015-02-04 | cif/ Updating files of 4085164, 4085165, 4085166, 4085167, 4085168, 4085169, 4085170 Original log message: Adding full bibliography for 4085164--4085170.cif. |
4085167.cif |
| 129258 | 2014-12-30 | cif/ Adding structures of 4085164, 4085165, 4085166, 4085167, 4085168, 4085169, 4085170 via cif-deposit CGI script. |
4085167.cif |
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Users of the data should acknowledge the original authors of the
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