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Information card for entry 7708317
Preview
| Coordinates | 7708317.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C107 H111 Br6 N17 O21 Pd3 |
|---|---|
| Calculated formula | C89.96 H72.92 Br6 N13 O14.48 Pd3 |
| Title of publication | Interconversion between Pd3L2 trigonal prism and Pd6L8 cube via anion exchange: binding affinity of monoatomic vs. polyatomic anions |
| Authors of publication | Lee, Haeri; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang |
| Journal of publication | Dalton Transactions |
| Year of publication | 2021 |
| a | 14.785 ± 0.003 Å |
| b | 26.13 ± 0.005 Å |
| c | 15.368 ± 0.003 Å |
| α | 90° |
| β | 108.44 ± 0.03° |
| γ | 90° |
| Cell volume | 5632 ± 2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.1244 |
| Residual factor for significantly intense reflections | 0.0703 |
| Weighted residual factors for significantly intense reflections | 0.1705 |
| Weighted residual factors for all reflections included in the refinement | 0.1935 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269195 (current) | 2021-09-18 | cif/ Adding structures of 7708317, 7708318, 7708319, 7708320, 7708321, 7708322 via cif-deposit CGI script. |
7708317.cif |
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