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Information card for entry 4068256
Preview
Coordinates | 4068256.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C55 H42 F3 O3 P3 Pd S |
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Calculated formula | C55 H42 F3 O3 P3 Pd S |
SMILES | [Pd]12([P](c3ccc4ccc5cccc6cc2c3c4c56)(c2ccccc2)c2ccccc2)[P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.S(=O)(=O)([O-])C(F)(F)F |
Title of publication | Switching on the Phosphorescence of Pyrene by Cycloplatination |
Authors of publication | Hu, Jian; Yip, John H. K.; Ma, Dik-Lung; Wong, Kwok-Yin; Chung, Wai-Hong |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 1 |
Pages of publication | 51 |
a | 9.3874 ± 0.0004 Å |
b | 14.5503 ± 0.0006 Å |
c | 17.689 ± 0.0007 Å |
α | 85.375 ± 0.001° |
β | 82.711 ± 0.001° |
γ | 80.332 ± 0.001° |
Cell volume | 2358.22 ± 0.17 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0918 |
Residual factor for significantly intense reflections | 0.0727 |
Weighted residual factors for significantly intense reflections | 0.1741 |
Weighted residual factors for all reflections included in the refinement | 0.1864 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
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/4068256.html
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