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Information card for entry 7039696
Preview
| Coordinates | 7039696.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (NHSi)Fe(N{SiMe3}2)2 |
|---|---|
| Formula | C83 H152 Fe2 N8 Si10 |
| Calculated formula | C83 H152 Fe2 N8 Si10 |
| Title of publication | A three-coordinate iron-silylene complex stabilized by ligand-ligand dispersion forces. |
| Authors of publication | Hänninen, Mikko M; Pal, Kuntal; Day, Benjamin M.; Pugh, Thomas; Layfield, Richard A. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2016 |
| Journal volume | 45 |
| Journal issue | 28 |
| Pages of publication | 11301 - 11305 |
| a | 11.3552 ± 0.0004 Å |
| b | 12.5187 ± 0.0004 Å |
| c | 18.5545 ± 0.0006 Å |
| α | 78.705 ± 0.003° |
| β | 89.821 ± 0.003° |
| γ | 75.266 ± 0.003° |
| Cell volume | 2498.4 ± 0.15 Å3 |
| Cell temperature | 150.01 ± 0.13 K |
| Ambient diffraction temperature | 150.01 ± 0.13 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 | 0.0624 |
| Residual factor for significantly intense reflections | 0.0433 |
| Weighted residual factors for significantly intense reflections | 0.0958 |
| Weighted residual factors for all reflections included in the refinement | 0.1057 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 185497 (current) | 2016-08-07 | cif/ Updating files of 7039696 Original log message: Adding full bibliography for 7039696.cif. |
7039696.cif |
| 184002 | 2016-06-28 | cif/ Adding structures of 7039696 via cif-deposit CGI script. |
7039696.cif |
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Users of the data should acknowledge the original authors of the
structural data.