Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4347143
Preview
| Coordinates | 4347143.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C336 H874 Cl98 Mn70 O360 |
|---|---|
| Calculated formula | C204 H334 Cl36 Mn70 O260 |
| Title of publication | Molecules at the Quantum-Classical Nanoparticle Interface: Giant Mn70 Single-Molecule Magnets of ∼4 nm Diameter. |
| Authors of publication | Vinslava, Alina; Tasiopoulos, Anastasios J.; Wernsdorfer, Wolfgang; Abboud, Khalil A.; Christou, George |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2016 |
| Journal volume | 55 |
| Journal issue | 7 |
| Pages of publication | 3419 - 3430 |
| a | 40.554 ± 0.004 Å |
| b | 52.19 ± 0.006 Å |
| c | 17.1744 ± 0.0019 Å |
| α | 90° |
| β | 108.378 ± 0.001° |
| γ | 90° |
| Cell volume | 34496 ± 6 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.11 |
| Residual factor for significantly intense reflections | 0.0618 |
| Weighted residual factors for significantly intense reflections | 0.1722 |
| Weighted residual factors for all reflections included in the refinement | 0.1826 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.885 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 232183 (current) | 2019-11-23 | cif/ Adding structures of 4347142, 4347143 via cif-deposit CGI script. |
4347143.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.