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Information card for entry 2242385
Preview
| Coordinates | 2242385.cif |
|---|---|
| Structure factors | 2242385.hkl |
| Original paper (by DOI) | HTML |
| Common name | Fe4NiS6 |
|---|---|
| Chemical name | Decacarbonyl(μ~3~-3,7-dithianonane-1,9-dithiolato)bis(μ~2~-propane-1,3-dithiolato)nickel(II)tetrairon(II) dichloromethane disolvate |
| Formula | C25 H30 Cl4 Fe4 Ni O10 S8 |
| Calculated formula | C25 H30 Cl4 Fe4 Ni O10 S8 |
| Title of publication | Synthesis and crystal structure of decacarbonyl(μ~3~-3,7-dithianonane-1,9-dithiolato)bis(μ~2~-propane-1,3-dithiolato)nickel(II)tetrairon(II) dichloromethane disolvate |
| Authors of publication | Ren, Gan; Sang, Ge |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2018 |
| Journal volume | 74 |
| Journal issue | 3 |
| Pages of publication | 328 - 331 |
| a | 12.434 ± 0.0008 Å |
| b | 13.9981 ± 0.001 Å |
| c | 14.4912 ± 0.0009 Å |
| α | 77.86 ± 0.004° |
| β | 67.57 ± 0.004° |
| γ | 64.036 ± 0.004° |
| Cell volume | 2093.3 ± 0.3 Å3 |
| Cell temperature | 243 ± 2 K |
| Ambient diffraction temperature | 243 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0445 |
| Residual factor for significantly intense reflections | 0.0319 |
| Weighted residual factors for significantly intense reflections | 0.0685 |
| Weighted residual factors for all reflections included in the refinement | 0.0751 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 206434 (current) | 2018-02-14 | cif/ hkl/ Adding structures of 2242385 via cif-deposit CGI script. |
2242385.cif 2242385.hkl |
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Users of the data should acknowledge the original authors of the
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