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Information card for entry 1504782
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 1504782.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49 H42 Cl2 F12 P4 |
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Calculated formula | C49 H42 Cl2 F12 P4 |
SMILES | c1c([P+](Cc2c3c(C[P+](c4ccccc4)(c4ccccc4)c4ccccc4)cccc3ccc2)(c2ccccc2)c2ccccc2)cccc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].ClCCl |
Title of publication | A novel fluoride ion colorimetric chemosensor. |
Authors of publication | Yeo, Hyoung Min; Ryu, Byung Ju; Nam, Kye Chun |
Journal of publication | Organic letters |
Year of publication | 2008 |
Journal volume | 10 |
Journal issue | 14 |
Pages of publication | 2931 - 2934 |
a | 11.1084 ± 0.0018 Å |
b | 14.51 ± 0.002 Å |
c | 15.814 ± 0.003 Å |
α | 92.665 ± 0.004° |
β | 106.583 ± 0.004° |
γ | 101.121 ± 0.004° |
Cell volume | 2383 ± 0.7 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 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 | 0.1812 |
Residual factor for significantly intense reflections | 0.0929 |
Weighted residual factors for significantly intense reflections | 0.2002 |
Weighted residual factors for all reflections included in the refinement | 0.2854 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
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/1504782.html
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Users of the data should acknowledge the original authors of the
structural data.