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Information card for entry 1548500
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| Coordinates | 1548500.cif |
|---|
| Formula | C100 H72 Au4 F12 N4 O16.8 P4 S4 |
|---|---|
| Calculated formula | C100 H72 Au4 F12 N4 O16.8 P4 S4 |
| Title of publication | Gold rectangle, silver rings and helices - A study of self-assembly and molecular recognition of metallo-supramolecules |
| Authors of publication | Lin Rong Er |
| Journal of publication | Ph.D Thesis - NATIONAL UNIVERSITY OF SINGAPORE |
| Year of publication | 2005 |
| Pages of publication | 1 |
| a | 28.242 ± 0.004 Å |
| b | 24.405 ± 0.004 Å |
| c | 10.3082 ± 0.0016 Å |
| α | 90° |
| β | 96.392 ± 0.003° |
| γ | 90° |
| Cell volume | 7060.7 ± 1.9 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for all reflections | 0.1365 |
| Residual factor for significantly intense reflections | 0.0748 |
| Weighted residual factors for significantly intense reflections | 0.2187 |
| Weighted residual factors for all reflections included in the refinement | 0.2426 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.968 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 204402 (current) | 2017-12-20 | cif/ Adding structures of 1548500 via cif-deposit CGI script. |
1548500.cif |
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Users of the data should acknowledge the original authors of the
structural data.