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Information card for entry 2018506
Preview
| Coordinates | 2018506.cif |
|---|---|
| Structure factors | 2018506.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>meso</i>-bis{η^5^-1-[1-(dimethylamino)ethenyl]-3- (trimethylsilyl)cyclopentadienyl}cobalt(II) |
|---|---|
| Formula | C24 H40 Co N2 Si2 |
| Calculated formula | C24 H40 Co N2 Si2 |
| SMILES | [c]12([cH]3[Co]4567891([c]([cH]24)([cH]38)C(=C)N(C)C)[c]1([cH]5[c]6([cH]7[cH]91)[Si](C)(C)C)C(=C)N(C)C)[Si](C)(C)C |
| Title of publication | <i>meso</i>-Bis{η^5^-1-[1-(dimethylamino)ethenyl]-3-(trimethylsilyl)cyclopentadienyl}iron(II) and the cobalt(II) analogue |
| Authors of publication | Duan, Xin-E; Tong, Hong-Bo; Bai, Sheng-Di; Wei, Xue-Hong; Liu, Dian-Sheng |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 6 |
| Pages of publication | m139 - m142 |
| a | 7.891 ± 0.002 Å |
| b | 9.363 ± 0.003 Å |
| c | 10.44 ± 0.003 Å |
| α | 105.531 ± 0.003° |
| β | 111.101 ± 0.003° |
| γ | 102.658 ± 0.003° |
| Cell volume | 649.2 ± 0.3 Å3 |
| Cell temperature | 213 ± 2 K |
| Ambient diffraction temperature | 213 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0394 |
| Residual factor for significantly intense reflections | 0.0365 |
| Weighted residual factors for significantly intense reflections | 0.091 |
| Weighted residual factors for all reflections included in the refinement | 0.0928 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2018506.html
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Users of the data should acknowledge the original authors of the
structural data.