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Information card for entry 7115690
Preview
Coordinates | 7115690.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C180 H132 K2 O26 Yb2 |
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Calculated formula | C180 H132 K2 O26 Yb2 |
SMILES | [K+].O1[Yb]234([O]=C(C(=C(c5ccccc5)O2)C(=O)c2ccccc2)c2ccccc2)([O]=C(C(=C(c2ccccc2)O3)C(=O)c2ccccc2)c2ccccc2)([O]=C(C(C(=O)c2ccccc2)=C1c1ccccc1)c1ccccc1)[O]=C(C(C(=O)c1ccccc1)=C(c1ccccc1)O4)c1ccccc1.C(O)C |
Title of publication | Lanthanoid beta-triketonates: a new class of highly efficient NIR emitters for bright NIR-OLEDs |
Authors of publication | Brodie L. Reid; Stefano Stagni; Joanna M. Malicka; Massimo Cocchi; Garry S. Hanan; Mark I. Ogden; Massimiliano Massi |
Journal of publication | Chem.Commun. |
Year of publication | 2014 |
Journal volume | 50 |
Pages of publication | 11580 |
a | 14.1075 ± 0.0012 Å |
b | 14.4693 ± 0.0012 Å |
c | 17.9695 ± 0.0014 Å |
α | 102.772 ± 0.004° |
β | 90.083 ± 0.004° |
γ | 91.038 ± 0.004° |
Cell volume | 3576.6 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0634 |
Residual factor for significantly intense reflections | 0.0589 |
Weighted residual factors for significantly intense reflections | 0.1549 |
Weighted residual factors for all reflections included in the refinement | 0.1622 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/7115690.html
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Users of the data should acknowledge the original authors of the
structural data.