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Information card for entry 1506825
Preview
Coordinates | 1506825.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C61 H66 Cl3 N8 O6 Tb |
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Calculated formula | C61 H66 Cl3 N8 O6 Tb |
SMILES | [Tb]1234(Oc5n(nc(c5C(=[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)[n]1cccc2ccc3ccc[n]4c3c12.C(Cl)(Cl)Cl |
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 | 12.8867 ± 0.0017 Å |
b | 13.9288 ± 0.0015 Å |
c | 19.09 ± 0.003 Å |
α | 69.13 ± 0.01° |
β | 77.076 ± 0.008° |
γ | 65.411 ± 0.004° |
Cell volume | 2899.9 ± 0.7 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 | 0.1281 |
Residual factor for significantly intense reflections | 0.0594 |
Weighted residual factors for significantly intense reflections | 0.091 |
Weighted residual factors for all reflections included in the refinement | 0.1023 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.761 |
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/1506825.html
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Users of the data should acknowledge the original authors of the
structural data.