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Information card for entry 7011533
Preview
Coordinates | 7011533.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C72 H40 Cu3 F6 N10 O16 S2 |
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Calculated formula | C72 H40 Cu3 F6 N10 O16 S2 |
SMILES | c1ccc2ccc3ccc[n]4c3c2[n]1[Cu]14([O]2C3=C(O[Cu]452([n]2cccc6ccc7ccc[n]4c7c26)[O](C2=C(O5)C(=O)C(=O)C2=O)[Cu]24([n]5cccc6ccc7ccc[n]2c7c56)[n]2cccc5ccc6ccc[n]4c6c25)C(=O)C(=O)C3=O)[n]2cccc3ccc4ccc[n]1c4c23.FC(F)(F)S(=O)(=O)[O-].FC(F)(F)S(=O)(=O)[O-] |
Title of publication | Syntheses, crystal structures and magnetic properties of di- and trinuclear croconato-bridged copper(ii) complexes |
Authors of publication | Castro, Isabel; Calatayud, María Luisa; Lloret, Francesc; Sletten, Jorunn; Julve, Miguel |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 2002 |
Journal issue | 11 |
Pages of publication | 2397 |
a | 28.2425 ± 0.0006 Å |
b | 10.9029 ± 0.0005 Å |
c | 21.8194 ± 0.0009 Å |
α | 90° |
β | 102.604 ± 0.002° |
γ | 90° |
Cell volume | 6556.8 ± 0.4 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.2315 |
Residual factor for significantly intense reflections | 0.0873 |
Weighted residual factors for significantly intense reflections | 0.1464 |
Weighted residual factors for all reflections included in the refinement | 0.1934 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7011533.html
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