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Information card for entry 7056399
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Coordinates | 7056399.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (Cu4-Complex 1) |
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Formula | C101 H176 Cu8 N8 O39 |
Calculated formula | C101 H176 Cu8 N8 O39 |
Title of publication | Nuclearity dependent solvent contribution on the catechol oxidase activity of novel Copper(II) complexes derived from Mannich-base ligand platforms: synthesis, crystal structure and mechanism |
Authors of publication | Sanyal, Ria; Ketkov, Sergey Yu.; Purkait, Suranjana; Mautner, Franz Andreas; Zhigulin, Grigory; Das, Debasis |
Journal of publication | New J. Chem. |
Year of publication | 2017 |
a | 12.548 ± 0.0016 Å |
b | 12.7661 ± 0.0016 Å |
c | 22.424 ± 0.003 Å |
α | 92.579 ± 0.006° |
β | 93.385 ± 0.006° |
γ | 117.938 ± 0.005° |
Cell volume | 3157.1 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.1814 |
Residual factor for significantly intense reflections | 0.1117 |
Weighted residual factors for significantly intense reflections | 0.2889 |
Weighted residual factors for all reflections included in the refinement | 0.3432 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7056399.html
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