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Information card for entry 7044824
Preview
| Coordinates | 7044824.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | cluster-3 |
|---|---|
| Formula | C66 H102 N8 Nd4 O46 Zn4 |
| Calculated formula | C66 H102 N8 Nd4 O46 Zn4 |
| SMILES | c12c3c(ccc2)C=[N]2CCN4CC[N]5=Cc6c7[O]8[Nd]9%10%11%12([O](c7ccc6)C)(ON(=[O]9)=O)([O]=C(O%10)C)OC(C)=[O][Nd]679%10%13([O]1C)([O]3[Zn]24([O]9[Zn]58([O]%117)[O]=C(C)O[Nd]1234578[O](C)c9cccc%11c9[O]1[Zn]19([N](=C%11)CCN1CC[N]1=Cc%11cccc%14[O](C)[Nd]%15%16%17([O](c%11%14)[Zn]1([O]5%17)([O]79)[O]=C(O6)C)(ON(=[O]%15)=O)([O]=C(O%16)C)(OC(C)=[O]2)[O]3C(C)=[O]4)[O]=C(C)O8)[O]=C(O%10)C)[O]%12C(C)=[O]%13.CO.OC.OC.O.CO.CO.CO.O |
| Title of publication | Construction of luminescent high-nuclearity Zn-Ln rectangular nanoclusters with flexible long-chain Schiff base ligands. |
| Authors of publication | Wang, Shiqing; Yang, Xiaoping; Zhu, Ting; Bo, Le; Wang, Ruihu; Huang, Shaoming; Wang, Chengri; Jiang, Dongmei; Chen, Hongfen; Jones, Richard A. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2017 |
| Journal volume | 47 |
| Journal issue | 1 |
| Pages of publication | 53 - 57 |
| a | 14.087 ± 0.005 Å |
| b | 14.64 ± 0.005 Å |
| c | 14.997 ± 0.005 Å |
| α | 62.231 ± 0.003° |
| β | 87.122 ± 0.004° |
| γ | 64.738 ± 0.004° |
| Cell volume | 2431.9 ± 1.5 Å3 |
| Cell temperature | 190 ± 1 K |
| Ambient diffraction temperature | 190 ± 1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0635 |
| Residual factor for significantly intense reflections | 0.05 |
| Weighted residual factors for significantly intense reflections | 0.1466 |
| Weighted residual factors for all reflections included in the refinement | 0.1656 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 229393 (current) | 2019-11-17 | cif/ Updating files of 7044823, 7044824, 7044825 Original log message: Adding full bibliography for 7044823--7044825.cif. |
7044824.cif |
| 203406 | 2017-11-21 | cif/ Adding structures of 7044823, 7044824, 7044825 via cif-deposit CGI script. |
7044824.cif |
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