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Information card for entry 7708982
Preview
| Coordinates | 7708982.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H50 Br2 N4 O2 Pd2 S2 |
|---|---|
| Calculated formula | C32 H50 Br2 N4 O2 Pd2 S2 |
| Title of publication | Mixed NHC–thiolato complexes of palladium: understanding the formation of di-versus mononuclear complexes |
| Authors of publication | Huynh, Han Vinh; Ong, Hong Lee; Ghatak, Kausani |
| Journal of publication | Dalton Transactions |
| Year of publication | 2021 |
| a | 12.0247 ± 0.0009 Å |
| b | 20.8936 ± 0.0015 Å |
| c | 8.5817 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2156.1 ± 0.3 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 18 |
| Hermann-Mauguin space group symbol | P 21 21 2 |
| Hall space group symbol | P 2 2ab |
| Residual factor for all reflections | 0.0316 |
| Residual factor for significantly intense reflections | 0.03 |
| Weighted residual factors for significantly intense reflections | 0.0852 |
| Weighted residual factors for all reflections included in the refinement | 0.086 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270968 (current) | 2021-12-02 | cif/ Adding structures of 7708982, 7708983, 7708984, 7708985, 7708986, 7708987, 7708988, 7708989 via cif-deposit CGI script. |
7708982.cif |
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Users of the data should acknowledge the original authors of the
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