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Information card for entry 1571432
Preview
| Coordinates | 1571432.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H46 Cl4 Mn N6 O6 |
|---|---|
| Calculated formula | C42 H46 Cl4 Mn N6 O6 |
| SMILES | [Mn]([OH]C)([OH]C)(OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl)([n]1ccn(c1)CCCCCCn1ccnc1)(OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl)[n]1ccn(c1)CCCCCCn1cc[n]([Mn]([OH]C)([OH]C)(OC(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)OC(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)c1 |
| Title of publication | Therapeutic coordination polymers: tailoring drug release through metal-ligand interactions. |
| Authors of publication | Murphy, Jennifer N.; Kobti, Joy-Lynn; Dao, Michelle; Wear, Darcy; Okoko, Michael; Pandey, Siyaram; Vukotic, V. Nicholas |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 19 |
| Pages of publication | 7041 - 7050 |
| a | 8.5133 ± 0.0002 Å |
| b | 20.8959 ± 0.0007 Å |
| c | 12.8879 ± 0.0004 Å |
| α | 90° |
| β | 107.409 ± 0.001° |
| γ | 90° |
| Cell volume | 2187.65 ± 0.11 Å3 |
| Cell temperature | 170 ± 0.1 K |
| Ambient diffraction temperature | 170 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0369 |
| Residual factor for significantly intense reflections | 0.0311 |
| Weighted residual factors for significantly intense reflections | 0.0802 |
| Weighted residual factors for all reflections included in the refinement | 0.0852 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 292886 (current) | 2024-07-05 | cif/ Updating files of 1571426, 1571427, 1571428, 1571429, 1571430, 1571431, 1571432, 1571433, 1571434, 1571435, 1571436 Original log message: Adding full bibliography for 1571426--1571436.cif. |
1571432.cif |
| 291200 | 2024-04-16 | cif/ Adding structures of 1571426, 1571427, 1571428, 1571429, 1571430, 1571431, 1571432, 1571433, 1571434, 1571435, 1571436 via cif-deposit CGI script. |
1571432.cif |
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Users of the data should acknowledge the original authors of the
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