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Information card for entry 7052731
Preview
| Coordinates | 7052731.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H22 Fe2 Si |
|---|---|
| Calculated formula | C21 H22 Fe2 Si |
| SMILES | [SiH](C)([c]12[cH]3[Fe]4567891([cH]3[cH]4[cH]25)[cH]1[cH]6[cH]7[cH]8[cH]91)[c]12[cH]3[Fe]4567891([cH]3[cH]4[cH]25)[cH]1[cH]6[cH]7[cH]8[cH]91 |
| Title of publication | Carbosilane based dendritic cores functionalized with interacting ferrocenyl units: synthesis and electrocatalytical properties |
| Authors of publication | Losada, José; García-Armada, Pilar; Robles, Víctor; Martínez, Ángel M.; Casado, Carmen M.; Alonso, Beatriz |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2011 |
| Journal volume | 35 |
| Journal issue | 10 |
| Pages of publication | 2187 |
| a | 9.8776 ± 0.0003 Å |
| b | 12.0035 ± 0.0004 Å |
| c | 15.5669 ± 0.0005 Å |
| α | 90° |
| β | 92.127 ± 0.002° |
| γ | 90° |
| Cell volume | 1844.43 ± 0.1 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0447 |
| Residual factor for significantly intense reflections | 0.0328 |
| Weighted residual factors for significantly intense reflections | 0.0808 |
| Weighted residual factors for all reflections included in the refinement | 0.0878 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180081 (current) | 2016-03-26 | cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/27. |
7052731.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7052731.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7052731.cif |
| 28141 | 2011-10-13 | ../uploads/cif-deposit/cod/cif Adding structures of 7052731 via cif-deposit CGI script. |
7052731.cif |
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Users of the data should acknowledge the original authors of the
structural data.