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Information card for entry 7034808
Preview
| Coordinates | 7034808.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C23 H23 Cu N3 O6 |
|---|---|
| Calculated formula | C23 H23 Cu N3 O6 |
| SMILES | [Cu]123(OC(=O)C[N]3(CC(=O)O1)Cc1ccccc1)[n]1cccc3c1c1[n]2cccc1cc3.O.O |
| Title of publication | Mixed ligand copper(ii) dicarboxylate complexes: the role of co-ligand hydrophobicity in DNA binding, double-strand DNA cleavage, protein binding and cytotoxicity. |
| Authors of publication | Loganathan, Rangasamy; Ramakrishnan, Sethu; Ganeshpandian, Mani; Bhuvanesh, Nattamai S. P.; Palaniandavar, Mallayan; Riyasdeen, Anvarbatcha; Akbarsha, Mohamad Abdulkadhar |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 22 |
| Pages of publication | 10210 - 10227 |
| a | 9.873 ± 0.003 Å |
| b | 16.336 ± 0.005 Å |
| c | 13.048 ± 0.004 Å |
| α | 90° |
| β | 99.869 ± 0.004° |
| γ | 90° |
| Cell volume | 2073.3 ± 1.1 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0567 |
| Residual factor for significantly intense reflections | 0.0489 |
| Weighted residual factors for significantly intense reflections | 0.1313 |
| Weighted residual factors for all reflections included in the refinement | 0.1385 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.097 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301849 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/03/ Each referenced PubChem compound corresponds to the full crystal structure. |
7034808.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7034808.cif |
| 138594 | 2015-06-07 | cif/ Updating files of 7034807, 7034808 Original log message: Adding full bibliography for 7034807--7034808.cif. |
7034808.cif |
| 135857 | 2015-05-09 | cif/ Adding structures of 7034807, 7034808 via cif-deposit CGI script. |
7034808.cif |
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