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Information card for entry 4126598
Preview
| Coordinates | 4126598.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C100 H128 Dy3 Fe6 I Li4 O10 |
|---|---|
| Calculated formula | C100 H128 Dy3 Fe6 I Li4 O10 |
| Title of publication | Hard Single-Molecule Magnet Behavior By a Linear Trinuclear Lanthanide-[1]Metallocenophane Complex. |
| Authors of publication | Latendresse, Trevor P.; Bhuvanesh, Nattamai S.; Nippe, Michael |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2017 |
| a | 10.9826 ± 0.0018 Å |
| b | 13.462 ± 0.002 Å |
| c | 17.649 ± 0.003 Å |
| α | 101.096 ± 0.006° |
| β | 105.259 ± 0.005° |
| γ | 104.987 ± 0.006° |
| Cell volume | 2334.8 ± 0.7 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0651 |
| Residual factor for significantly intense reflections | 0.0545 |
| Weighted residual factors for significantly intense reflections | 0.1101 |
| Weighted residual factors for all reflections included in the refinement | 0.119 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.19 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 202060 (current) | 2017-10-18 | cif/ Adding structures of 4126598 via cif-deposit CGI script. |
4126598.cif |
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