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Information card for entry 4000125
Preview
| Coordinates | 4000125.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H12 Cl4 Co0.05 Fe0.95 S12 |
|---|---|
| Calculated formula | C14 H12 Cl4 Co0.47 S12 |
| SMILES | Cl[Co](Cl)([Cl-])[Cl-].CSC1=C(SC)SC(=C2SC3=C(S2)SC(=C2SC(=C(S2)SC)SC)S3)S1 |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2002 |
| a | 24.08 ± 0.02 Å |
| b | 5.838 ± 0.009 Å |
| c | 22.46 ± 0.02 Å |
| α | 90° |
| β | 118.94 ± 0.04° |
| γ | 90° |
| Cell volume | 2762 ± 5 Å3 |
| Cell temperature | 293.2 K |
| Ambient diffraction temperature | 293.2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|
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Users of the data should acknowledge the original authors of the
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