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Information card for entry 4116376
Preview
| Coordinates | 4116376.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C186 H234 Ga4 N30 O42 |
|---|---|
| Calculated formula | C197 H163 Ga4 N20 O32 |
| Title of publication | Dynamic Isomerization of a Supramolecular Tetrahedral M4L6 Cluster1 |
| Authors of publication | Thomas Beissel; Ryan E. Powers; Tatjana N. Parac; Kenneth N. Raymond |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 1999 |
| Journal volume | 121 |
| Pages of publication | 4200 - 4206 |
| a | 24.0738 ± 0.0002 Å |
| b | 24.0738 ± 0.0002 Å |
| c | 68.5828 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 39747 ± 0.5 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 88 |
| Hermann-Mauguin space group symbol | I 41/a :2 |
| Hall space group symbol | -I 4ad |
| Residual factor for all reflections | 0.1234 |
| Residual factor for significantly intense reflections | 0.0888 |
| Weighted residual factors for all reflections | 0.2523 |
| Weighted residual factors for significantly intense reflections | 0.2205 |
| Goodness-of-fit parameter for all reflections | 1.033 |
| Goodness-of-fit parameter for significantly intense reflections | 1.085 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.