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Information card for entry 7112254
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| Coordinates | Coordinates are not available: file is not found. |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | PGC4GaCd |
|---|---|
| Formula | C270 H452 Cd3 Ga17 N4 O152 |
| Calculated formula | C268 H264 Cd3 Ga17 N4 O151.8 |
| Title of publication | Structural alteration of the metal-organic pyrogallol[4]arene nano-capsule motif by incorporation of large metal centres |
| Authors of publication | Ping Jin; Harshita Kumari; Stuart Kennedy; Charles L. Barnes; Simon J. Teat; Scott J. Dalgarno; Jerry L. Atwood |
| Journal of publication | Chem.Commun. |
| Year of publication | 2014 |
| Journal volume | 50 |
| Pages of publication | 4508 |
| a | 32.6322 ± 0.0013 Å |
| b | 27.6208 ± 0.0011 Å |
| c | 44.2453 ± 0.0017 Å |
| α | 90° |
| β | 97.087 ± 0.002° |
| γ | 90° |
| Cell volume | 39575 ± 3 Å3 |
| Cell temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1528 |
| Residual factor for significantly intense reflections | 0.1095 |
| Weighted residual factors for significantly intense reflections | 0.3085 |
| Weighted residual factors for all reflections included in the refinement | 0.3413 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.31 |
| Diffraction radiation wavelength | 0.7749 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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