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Information card for entry 7060066
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7060066.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H32 Cu2 F6 N2 O10 |
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Calculated formula | C42 H32 Cu2 F6 N2 O10 |
Title of publication | Solvent induced mononuclear and dinuclear mixed ligand Cu(ii) complex: structural diversity, supramolecular packing polymorphism and molecular docking studies |
Authors of publication | Mahesha,; Hema, M. K.; Karthik, C. S.; Pampa, K. J.; Mallu, P.; Lokanath, N. K. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2020 |
Journal volume | 44 |
Journal issue | 41 |
Pages of publication | 18048 - 18068 |
a | 8.56 ± 0.002 Å |
b | 22.75 ± 0.005 Å |
c | 11.02 ± 0.003 Å |
α | 90° |
β | 111.64 ± 0.003° |
γ | 90° |
Cell volume | 1994.8 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/a 1 |
Hall space group symbol | -P 2yab |
Residual factor for all reflections | 0.1402 |
Residual factor for significantly intense reflections | 0.0847 |
Weighted residual factors for significantly intense reflections | 0.2083 |
Weighted residual factors for all reflections included in the refinement | 0.2506 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.985 |
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/7060066.html
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Users of the data should acknowledge the original authors of the
structural data.