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Information card for entry 4348834
Preview
| Coordinates | 4348834.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C120 H12 Au12 F72 N24 |
|---|---|
| Calculated formula | C119.976 H12 Au12 F72 N24 |
| Title of publication | Coinage Metal Pyrazolates [(3,5-(CF3)2Pz)M]3 (M = Au, Ag, Cu) as Buckycatchers. |
| Authors of publication | Jayaratna, Naleen B.; Olmstead, Marilyn M.; Kharisov, Boris I.; Dias, H. V. Rasika |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2016 |
| Journal volume | 55 |
| Journal issue | 17 |
| Pages of publication | 8277 - 8280 |
| a | 36.823 ± 0.006 Å |
| b | 36.823 ± 0.006 Å |
| c | 36.823 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 49930 ± 14 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 228 |
| Hermann-Mauguin space group symbol | F d -3 c :2 |
| Hall space group symbol | -F 4ud 2vw 3 |
| Residual factor for all reflections | 0.0366 |
| Residual factor for significantly intense reflections | 0.0257 |
| Weighted residual factors for significantly intense reflections | 0.0582 |
| Weighted residual factors for all reflections included in the refinement | 0.0702 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.306 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233418 (current) | 2019-11-23 | cif/ Adding structures of 4348834 via cif-deposit CGI script. |
4348834.cif |
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Users of the data should acknowledge the original authors of the
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