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Information card for entry 7039115
Preview
Coordinates | 7039115.cif |
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Original paper (by DOI) | HTML |
Formula | C18 H24 Cu N2 O5 |
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Calculated formula | C18 H24 Cu N2 O5 |
SMILES | [Cu]12([N](=Cc3c(O1)ccc1ccccc31)CC[NH]2CC(O)C)OC(=O)C.O |
Title of publication | Mixed-ligand copper(ii) Schiff base complexes: the role of the co-ligand in DNA binding, DNA cleavage, protein binding and cytotoxicity. |
Authors of publication | Lian, Wen-Jing; Wang, Xin-Tian; Xie, Cheng-Zhi; Tian, He; Song, Xue-Qing; Pan, He-Ting; Qiao, Xin; Xu, Jing-Yuan |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 22 |
Pages of publication | 9073 - 9087 |
a | 21.607 ± 0.004 Å |
b | 6.255 ± 0.0013 Å |
c | 26.077 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3524.4 ± 1.2 Å3 |
Cell temperature | 113 ± 2 K |
Ambient diffraction temperature | 113 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0636 |
Residual factor for significantly intense reflections | 0.0562 |
Weighted residual factors for significantly intense reflections | 0.1241 |
Weighted residual factors for all reflections included in the refinement | 0.1284 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.143 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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