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Information card for entry 1550065
Preview
| Coordinates | 1550065.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C72 H92 N6 Si2 |
|---|---|
| Calculated formula | C72 H92 N6 Si2 |
| Title of publication | Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule. |
| Authors of publication | Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo |
| Journal of publication | Chemical science |
| Year of publication | 2018 |
| Journal volume | 9 |
| Journal issue | 45 |
| Pages of publication | 8474 - 8481 |
| a | 10.4966 ± 0.0005 Å |
| b | 12.3975 ± 0.0008 Å |
| c | 13.2265 ± 0.001 Å |
| α | 104.289 ± 0.006° |
| β | 99.208 ± 0.005° |
| γ | 101.826 ± 0.005° |
| Cell volume | 1591.78 ± 0.19 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1048 |
| Residual factor for significantly intense reflections | 0.0734 |
| Weighted residual factors for significantly intense reflections | 0.182 |
| Weighted residual factors for all reflections included in the refinement | 0.2053 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Diffraction radiation X-ray symbol | K-L~3~ |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 228842 (current) | 2019-11-17 | cif/ Updating files of 1550065, 1550066, 1550067, 1550068, 1550069, 1550070, 1550071, 1550072, 1550073, 1550074, 1550075, 1550076, 1550077 Original log message: Adding full bibliography for 1550065--1550077.cif. |
1550065.cif |
| 211553 | 2018-10-20 | cif/ Adding structures of 1550065, 1550066, 1550067, 1550068, 1550069, 1550070, 1550071, 1550072, 1550073, 1550074, 1550075, 1550076, 1550077 via cif-deposit CGI script. |
1550065.cif |
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Users of the data should acknowledge the original authors of the
structural data.