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Information card for entry 7036887
Preview
Coordinates | 7036887.cif |
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Original paper (by DOI) | HTML |
Formula | C27 H22 Cu N4 O4 |
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Calculated formula | C27 H22 Cu N4 O4 |
SMILES | c12ccc3ccccc3c1C=[N]1c3ccccc3c3[n](c4c(cccc4)n3CCC)[Cu]1(O2)ON(=O)=O |
Title of publication | Synthesis, DNA binding, cellular DNA lesion and cytotoxicity of a series of new benzimidazole-based Schiff base copper(ii) complexes. |
Authors of publication | Paul, Anup; Anbu, Sellamuthu; Sharma, Gunjan; Kuznetsov, Maxim L.; Koch, Biplob; Guedes da Silva, M Fátima C; Pombeiro, Armando J. L. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 46 |
Pages of publication | 19983 - 19996 |
a | 9.9413 ± 0.0007 Å |
b | 15.3917 ± 0.001 Å |
c | 17.7468 ± 0.0011 Å |
α | 69.236 ± 0.003° |
β | 85.698 ± 0.005° |
γ | 72.483 ± 0.003° |
Cell volume | 2419.8 ± 0.3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1497 |
Residual factor for significantly intense reflections | 0.102 |
Weighted residual factors for significantly intense reflections | 0.2552 |
Weighted residual factors for all reflections included in the refinement | 0.2796 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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