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Information card for entry 7705686
Preview
| Coordinates | 7705686.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C82 H70 N2 O2 Sm |
|---|---|
| Calculated formula | C82 H70 N2 O2 Sm |
| SMILES | [Sm]1234N(C5=C(N1c1c(cc(cc1C(c1ccccc1)c1ccccc1)C)C(c1ccccc1)c1ccccc1)c1c6c5cccc6ccc1)c1c(cc(cc1C(c1ccccc1)c1ccccc1)C)C([c]12ccc[cH]4[cH]31)c1ccccc1.O(C)CCOC |
| Title of publication | Low-coordinate Sm(II) and Yb(II) complexes derived from sterically-hindered 1,2-bis(imino)acenaphthene (Ar<sup>BIG</sup>-bian). |
| Authors of publication | Lukina, Daria A.; Skatova, Alexandra A.; Sokolov, Vladimir G.; Baranov, Evgenii V.; Demeshko, Serhiy; Ketkov, Sergey Yu; Fedushkin, Igor L. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2020 |
| Journal volume | 49 |
| Journal issue | 41 |
| Pages of publication | 14445 - 14451 |
| a | 13.7407 ± 0.0011 Å |
| b | 18.7955 ± 0.0017 Å |
| c | 24.607 ± 0.002 Å |
| α | 90° |
| β | 104.497 ± 0.003° |
| γ | 90° |
| Cell volume | 6152.7 ± 0.9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0938 |
| Residual factor for significantly intense reflections | 0.0544 |
| Weighted residual factors for significantly intense reflections | 0.0858 |
| Weighted residual factors for all reflections included in the refinement | 0.0952 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287906 (current) | 2023-11-30 | cif/7/ (antanas@oposumas) Removed data items that had the '\^A' values from multiple entries. These values convey no meaning and most likely arose due to data corruption. The same values are also present in the original supplementary material data files. |
7705686.cif |
| 258798 | 2020-11-06 | cif/ Updating files of 7705684, 7705685, 7705686 Original log message: Adding full bibliography for 7705684--7705686.cif. |
7705686.cif |
| 258355 | 2020-10-14 | cif/ Adding structures of 7705684, 7705685, 7705686 via cif-deposit CGI script. |
7705686.cif |
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