Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1566163
Preview
| Coordinates | 1566163.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C608 H384 F60 N96 O64 Pd8 Sb10 |
|---|---|
| Calculated formula | C608 H384 F60 N96 O64 Pd8 Sb10 |
| Title of publication | Cooperativity of steric bulk and H-bonding in coordination sphere engineering: heteroleptic PdII cages and bowls by design |
| Authors of publication | Chen, Bin; Holstein, Julian J.; Platzek, André; Schneider, Laura; Wu, Kai; Clever, Guido H. |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 41.972 ± 0.008 Å |
| b | 70.711 ± 0.014 Å |
| c | 27.616 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 81961 ± 3 Å3 |
| Cell temperature | 80 ± 2 K |
| Ambient diffraction temperature | 80 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 56 |
| Hermann-Mauguin space group symbol | P c c n |
| Hall space group symbol | -P 2ab 2ac |
| Residual factor for all reflections | 0.1676 |
| Residual factor for significantly intense reflections | 0.1294 |
| Weighted residual factors for significantly intense reflections | 0.3728 |
| Weighted residual factors for all reflections included in the refinement | 0.4034 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.649 |
| Diffraction radiation wavelength | 0.6888 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272259 (current) | 2022-01-27 | cif/ Adding structures of 1566161, 1566162, 1566163 via cif-deposit CGI script. |
1566163.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.