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Information card for entry 7062615
Preview
| Coordinates | 7062615.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H36 N3 O3 P Pd S |
|---|---|
| Calculated formula | C36 H36 N3 O3 P Pd S |
| SMILES | C1C2=C(O[Pd]3([N]=1N=C(S3)NC1CCCCC1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1OC2OC |
| Title of publication | Michael addition-driven synthesis of cytotoxic palladium(ii) complexes from chromone thiosemicarbazones: investigation of anticancer activity through in vitro and in vivo studies |
| Authors of publication | Haribabu, Jebiti; Balakrishnan, Nithya; Swaminathan, Srividya; Dorairaj, Dorothy Priyanka; Azam, Mohammad; Subarkhan, Mohamed Kasim Mohamed; Chang, Yu-Lun; Hsu, Sodio C. N.; Štarha, Pavel; Karvembu, Ramasamy |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2023 |
| Journal volume | 47 |
| Journal issue | 33 |
| Pages of publication | 15748 - 15759 |
| a | 14.9766 ± 0.0003 Å |
| b | 15.6463 ± 0.0003 Å |
| c | 14.7578 ± 0.0003 Å |
| α | 90° |
| β | 107.475 ± 0.002° |
| γ | 90° |
| Cell volume | 3298.57 ± 0.12 Å3 |
| Cell temperature | 113 ± 2 K |
| Ambient diffraction temperature | 113 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0364 |
| Residual factor for significantly intense reflections | 0.031 |
| Weighted residual factors for significantly intense reflections | 0.0657 |
| Weighted residual factors for all reflections included in the refinement | 0.0676 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.086 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286163 (current) | 2023-09-05 | cif/ Updating files of 7062615 Original log message: Adding full bibliography for 7062615.cif. |
7062615.cif |
| 285319 | 2023-07-22 | cif/ Adding structures of 7062615 via cif-deposit CGI script. |
7062615.cif |
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