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Information card for entry 7032662
Preview
Coordinates | 7032662.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H28 Cl2 N10 O8 Ru S2 |
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Calculated formula | C42 H28 Cl2 N10 O8 Ru S2 |
SMILES | [Ru]1234([n]5cccc6c5c5[n]1c(ccc5cc6)c1[n]2nc2c(n1)c1ccccc1c1ccccc21)[n]1ccsc1c1[n]3c(ccc1)c1[n]4ccs1.N#CC.N#CC.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-] |
Title of publication | Dual inhibition of topoisomerases I and IIα by ruthenium(ii) complexes containing asymmetric tridentate ligands. |
Authors of publication | Du, Kejie; Liang, Jiewen; Wang, Yi; Kou, Junfeng; Qian, Chen; Ji, Liangnian; Chao, Hui |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 46 |
Pages of publication | 17303 - 17316 |
a | 12.052 ± 0.002 Å |
b | 12.336 ± 0.003 Å |
c | 16.06 ± 0.003 Å |
α | 97.37 ± 0.03° |
β | 109.39 ± 0.03° |
γ | 109.22 ± 0.03° |
Cell volume | 2049.7 ± 1.1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0994 |
Residual factor for significantly intense reflections | 0.05 |
Weighted residual factors for significantly intense reflections | 0.1199 |
Weighted residual factors for all reflections included in the refinement | 0.1664 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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