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Information card for entry 7159210
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Coordinates | 7159210.cif |
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Original paper (by DOI) | HTML |
Chemical name | Copper di-[5-(2-methoxyethoxy)methyl)pyridine-2-thiolate-N-oxide] |
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Formula | C18 H24 Cu N2 O6 S2 |
Calculated formula | C18 H24 Cu N2 O6 S2 |
Title of publication | Water-soluble copper pyrithione complexes with cytotoxic and antibacterial activity. |
Authors of publication | Mishra, Atreyee; Djoko, Karrera Y.; Lee, Yi-Hsuan; Lord, Rianne M.; Kaul, Grace; Akhir, Abdul; Saxena, Deepanshi; Chopra, Sidharth; Walton, James W. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2023 |
Journal volume | 21 |
Journal issue | 12 |
Pages of publication | 2539 - 2544 |
a | 4.2745 ± 0.0002 Å |
b | 16.1974 ± 0.0007 Å |
c | 23.4885 ± 0.0011 Å |
α | 106.784 ± 0.002° |
β | 92.454 ± 0.002° |
γ | 95.446 ± 0.002° |
Cell volume | 1545.73 ± 0.12 Å3 |
Cell temperature | 130 K |
Ambient diffraction temperature | 130 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0557 |
Residual factor for significantly intense reflections | 0.0399 |
Weighted residual factors for significantly intense reflections | 0.0694 |
Weighted residual factors for all reflections included in the refinement | 0.074 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7159210.html
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