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Information card for entry 7017339
Preview
| Coordinates | 7017339.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C42 H30 Cl2 N6 O8 Zn |
|---|---|
| Calculated formula | C42 H30 Cl2 N6 O8 Zn |
| SMILES | [Zn]1234([n]5c(c6[n]1c(c1[n]2cccc1)cc(c6)c1ccccc1)cccc5)[n]1ccccc1c1[n]3c(cc(c1)c1ccccc1)c1[n]4cccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-] |
| Title of publication | Impact of metal on the DNA photocleavage activity and cytotoxicity of ferrocenyl terpyridine 3d metal complexes. |
| Authors of publication | Maity, Basudev; Gadadhar, Sudarshan; Goswami, Tridib K.; Karande, Anjali A.; Chakravarty, Akhil R. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 44 |
| Pages of publication | 11904 - 11913 |
| a | 9.5145 ± 0.0003 Å |
| b | 12.8131 ± 0.0005 Å |
| c | 31.5604 ± 0.0012 Å |
| α | 90° |
| β | 97.368 ± 0.002° |
| γ | 90° |
| Cell volume | 3815.8 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.1007 |
| Residual factor for significantly intense reflections | 0.0642 |
| Weighted residual factors for significantly intense reflections | 0.1766 |
| Weighted residual factors for all reflections included in the refinement | 0.2005 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301847 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/01/ Each referenced PubChem compound corresponds to the full crystal structure. |
7017339.cif |
| 179877 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/73. |
7017339.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7017339.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7017339.cif |
| 31312 | 2011-12-13 | ../uploads/cif-deposit/cod/cif Adding structures of 7017337, 7017338, 7017339, 7017340 via cif-deposit CGI script. |
7017339.cif |
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