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Information card for entry 4085170
Preview
| Coordinates | 4085170.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C69 H126 N15 Nd3 Si6 |
|---|---|
| Calculated formula | C69 H126 N15 Nd3 Si6 |
| SMILES | [c]12(C)[cH]3[cH]4[c]5(C)[n]16CCN(CCn1c(ccc1C)C)[Nd]123456([N]#C[Nd]23456([cH]7[cH]3[c]4(C)[n]5([c]67C)CCN2CCn2c(ccc2C)C)(N([Si](C)(C)C)[Si](C)(C)C)[N]#C[Nd]23456([cH]7[cH]3[c]4(C)[n]5([c]67C)CCN2CCn2c(ccc2C)C)(N([Si](C)(C)C)[Si](C)(C)C)[N]#C1)N([Si](C)(C)C)[Si](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 | 22.56 ± 0.0007 Å |
| b | 22.56 ± 0.0007 Å |
| c | 30.006 ± 0.0019 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 13225.6 ± 1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 161 |
| Hermann-Mauguin space group symbol | R 3 c :H |
| Hall space group symbol | R 3 -2"c |
| Residual factor for all reflections | 0.03 |
| Residual factor for significantly intense reflections | 0.0258 |
| Weighted residual factors for significantly intense reflections | 0.0622 |
| Weighted residual factors for all reflections included in the refinement | 0.064 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
| 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. |
4085170.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. |
4085170.cif |
| 129258 | 2014-12-30 | cif/ Adding structures of 4085164, 4085165, 4085166, 4085167, 4085168, 4085169, 4085170 via cif-deposit CGI script. |
4085170.cif |
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Users of the data should acknowledge the original authors of the
structural data.