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Information card for entry 7056308
Preview
Coordinates | 7056308.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H34 Cu N4 O4 |
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Calculated formula | C30 H34 Cu N4 O4 |
SMILES | c1cccc2[C@](C)(C[C@](O)(C)c3ncccc3)O[Cu]3([n]12)[n]1ccccc1[C@@](C)(C[C@@](O)(C)c1ncccc1)O3 |
Title of publication | Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes |
Authors of publication | Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H. |
Journal of publication | New J. Chem. |
Year of publication | 2017 |
a | 8.3252 ± 0.0003 Å |
b | 14.6827 ± 0.0005 Å |
c | 11.7096 ± 0.0008 Å |
α | 90° |
β | 105.716 ± 0.007° |
γ | 90° |
Cell volume | 1377.83 ± 0.13 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0355 |
Residual factor for significantly intense reflections | 0.0323 |
Weighted residual factors for significantly intense reflections | 0.0789 |
Weighted residual factors for all reflections included in the refinement | 0.0805 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
Diffraction radiation wavelength | 0.71075 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/7056308.html
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