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Information card for entry 4129948
Preview
| Coordinates | 4129948.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C194 H288 B2 Cu34 F8 O2 |
|---|---|
| Calculated formula | C194 H288 B2 Cu34 F8 O2 |
| Title of publication | Comproportionation Synthesis of Copper(I) Alkynyl Complexes Encapsulating Polyoxomolybdate Templates: Bowl-Shaped Cu33 and Peanut-Shaped Cu62 Nanoclusters. |
| Authors of publication | Zhang, Li-Min; Mak, Thomas C. W. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 9 |
| Pages of publication | 2909 - 2912 |
| a | 26.473 ± 0.004 Å |
| b | 15.889 ± 0.002 Å |
| c | 54.655 ± 0.007 Å |
| α | 90° |
| β | 101.963 ± 0.007° |
| γ | 90° |
| Cell volume | 22490 ± 5 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1688 |
| Residual factor for significantly intense reflections | 0.1079 |
| Weighted residual factors for significantly intense reflections | 0.2745 |
| Weighted residual factors for all reflections included in the refinement | 0.3302 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240568 (current) | 2019-11-25 | cif/ Adding structures of 4129948, 4129949, 4129950, 4129951 via cif-deposit CGI script. |
4129948.cif |
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Users of the data should acknowledge the original authors of the
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