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Information card for entry 1573118
Preview
| Coordinates | 1573118.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C69 H84 Er N8 |
|---|---|
| Calculated formula | C62 H76 Er N8 |
| SMILES | [Er]123([N](=Cc4c2n(c2c4cccc2)CCN2CCCCC2)C24CC5CC(C2)CC(C4)C5)([N](=Cc2c3n(c3c2cccc3)CCN2CCCCC2)C23CC4CC(C2)CC(C3)C4)[n]2ccccc2c2[n]1cccc2 |
| Title of publication | Rare-earth metal complexes bearing electrophilic and nucleophilic carbon centres and their unique reactivity patterns towards pyridine derivatives. |
| Authors of publication | Wu, Weikang; Rajeshkumar, Thayalan; Zhu, Shan; Chai, Fuxiang; Hong, Dongjing; Huang, Zeming; Yuan, Qingbing; Maron, Laurent; Wang, Shaowu |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 48 |
| Pages of publication | 20315 - 20327 |
| a | 14.584 ± 0.009 Å |
| b | 14.899 ± 0.009 Å |
| c | 15.053 ± 0.009 Å |
| α | 75.276 ± 0.006° |
| β | 84.282 ± 0.006° |
| γ | 74.311 ± 0.006° |
| Cell volume | 3044 ± 3 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 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 | 0.228 |
| Residual factor for significantly intense reflections | 0.1202 |
| Weighted residual factors for significantly intense reflections | 0.2386 |
| Weighted residual factors for all reflections included in the refinement | 0.2746 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.957 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297098 (current) | 2025-01-06 | cif/ Updating files of 1573095, 1573096, 1573097, 1573098, 1573099, 1573100, 1573101, 1573102, 1573103, 1573104, 1573105, 1573106, 1573107, 1573108, 1573109, 1573110, 1573111, 1573112, 1573113, 1573114, 1573115, 1573116, 1573117, 1573118, 1573119, 1573120, 1573121, 1573122, 1573123, 1573124, 1573125, 1573126, 1573127, 1573128, 1573129, 1573130, 1573131, 1573132, 1573133, 1573134, 1573135, 1573136, 1573137, 1573138 Original log message: Adding full bibliography for 1573095--1573138.cif. |
1573118.cif |
| 295890 | 2024-11-13 | cif/ Adding structures of 1573095, 1573096, 1573097, 1573098, 1573099, 1573100, 1573101, 1573102, 1573103, 1573104, 1573105, 1573106, 1573107, 1573108, 1573109, 1573110, 1573111, 1573112, 1573113, 1573114, 1573115, 1573116, 1573117, 1573118, 1573119, 1573120, 1573121, 1573122, 1573123 via cif-deposit CGI script. |
1573118.cif |
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Users of the data should acknowledge the original authors of the
structural data.