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Information card for entry 7048565
Preview
| Coordinates | 7048565.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H48 N6 Na2 O14 S2 |
|---|---|
| Calculated formula | C44 H48 N6 Na2 O14 S2 |
| SMILES | S12(=O)=[O][Na]3([O]=S(=O)(c4c5c(cccc5)ccc4NN=C(C(=[O]3)Nc3ccccc3)C(=O)C)O[Na](O1)([O]=C(C(=NNc1c2c2c(cccc2)cc1)C(=O)C)Nc1ccccc1)([OH]C)[OH]C)([OH]C)[OH]C |
| Title of publication | Arylhydrazone ligands as Cu-protectors and -catalysis promoters in the azide-alkyne cycloaddition reaction. |
| Authors of publication | Mahmoud, Abdallah G.; Guedes da Silva, M Fátima C; Mahmudov, Kamran T.; Pombeiro, Armando J. L. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 5 |
| Pages of publication | 1774 - 1785 |
| a | 7.3204 ± 0.0013 Å |
| b | 12.411 ± 0.002 Å |
| c | 13.597 ± 0.002 Å |
| α | 86.394 ± 0.009° |
| β | 75.139 ± 0.009° |
| γ | 75.607 ± 0.01° |
| Cell volume | 1156.5 ± 0.3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 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 | 0.0626 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for significantly intense reflections | 0.1038 |
| Weighted residual factors for all reflections included in the refinement | 0.1158 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 223996 (current) | 2019-11-07 | cif/ Updating files of 7048560, 7048561, 7048562, 7048563, 7048564, 7048565, 7048566 Original log message: Adding full bibliography for 7048560--7048566.cif. |
7048565.cif |
| 212966 | 2019-01-11 | cif/ Adding structures of 7048560, 7048561, 7048562, 7048563, 7048564, 7048565, 7048566 via cif-deposit CGI script. |
7048565.cif |
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Users of the data should acknowledge the original authors of the
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