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Information card for entry 4342322
Preview
Coordinates | 4342322.cif |
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Original paper (by DOI) | HTML |
Formula | C20 H16 Cu F6 N8 P |
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Calculated formula | C20 H16 Cu F6 N8 P |
SMILES | [Cu]12([n]3ccccc3N=[N]1c1ccccn1)[n]1ccccc1N=[N]2c1ccccn1.[P](F)(F)(F)(F)(F)[F-] |
Title of publication | Tris(2,2'-azobispyridine) Complexes of Copper(II): X-ray Structures, Reactivities, and the Radical Nonradical Bis(ligand) Analogues. |
Authors of publication | Maity, Suvendu; Kundu, Suman; Weyhermüller, Thomas; Ghosh, Prasanta |
Journal of publication | Inorganic chemistry |
Year of publication | 2015 |
Journal volume | 54 |
Journal issue | 4 |
Pages of publication | 1300 - 1313 |
a | 7.3353 ± 0.0003 Å |
b | 12.3442 ± 0.0006 Å |
c | 12.7166 ± 0.0009 Å |
α | 100.635 ± 0.004° |
β | 92.653 ± 0.004° |
γ | 100.53 ± 0.004° |
Cell volume | 1108.81 ± 0.11 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0486 |
Residual factor for significantly intense reflections | 0.037 |
Weighted residual factors for significantly intense reflections | 0.0923 |
Weighted residual factors for all reflections included in the refinement | 0.0997 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
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/4342322.html
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