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Information card for entry 1506824
Preview
Coordinates | 1506824.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C33 H36 N3 O3.5 P0.5 Tb0.5 |
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Calculated formula | C33 H36 N3 O3.5 P0.5 Tb0.5 |
SMILES | [Tb]123(Oc4n(nc(c4C(=[O]1)CC(C)(C)C)C)c1ccccc1)(Oc1n(nc(c1C(=[O]2)CC(C)(C)C)C)c1ccccc1)(Oc1n(nc(c1C(=[O]3)CC(C)(C)C)C)c1ccccc1)[O]=P(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | The Effect of Different Neutral Ligands on Photoluminescence and Electroluminescence Properties of Ternary Terbium Complexes |
Authors of publication | Xin, Hao; Shi, Mei; Gao, Xi Cun; Huang, Yan Yi; Gong, Ze Liang; Nie, Dao Bo; Cao, Hong; Bian, Zu Qiang; Li, Fu You; Huang, Chun Hui |
Journal of publication | The Journal of Physical Chemistry B |
Year of publication | 2004 |
Journal volume | 108 |
Journal issue | 30 |
Pages of publication | 10796 |
a | 12.049 ± 0.002 Å |
b | 13.986 ± 0.003 Å |
c | 18.529 ± 0.004 Å |
α | 96.74 ± 0.03° |
β | 104.78 ± 0.03° |
γ | 90.23 ± 0.03° |
Cell volume | 2996.4 ± 1.1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0583 |
Residual factor for significantly intense reflections | 0.0464 |
Weighted residual factors for significantly intense reflections | 0.1199 |
Weighted residual factors for all reflections included in the refinement | 0.1299 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
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/1506824.html
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Users of the data should acknowledge the original authors of the
structural data.