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Information card for entry 4121836
Preview
Coordinates | 4121836.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H38 Au F3 I P |
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Calculated formula | C25 H38 Au F3 I P |
SMILES | C(F)(F)(F)[Au](c1ccccc1)([P](C1CCCCC1)(C1CCCCC1)C1CCCCC1)I |
Title of publication | Photoinitiated Oxidative Addition of CF3I to Gold(I) and Facile Aryl-CF3 Reductive Elimination. |
Authors of publication | Winston, Matthew S.; Wolf, William J.; Toste, F. Dean |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 21 |
Pages of publication | 7777 - 7782 |
a | 18.0923 ± 0.0009 Å |
b | 14.9606 ± 0.0007 Å |
c | 20.1354 ± 0.0011 Å |
α | 90° |
β | 107.34 ± 0.002° |
γ | 90° |
Cell volume | 5202.4 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0236 |
Residual factor for significantly intense reflections | 0.0194 |
Weighted residual factors for significantly intense reflections | 0.0377 |
Weighted residual factors for all reflections included in the refinement | 0.0388 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4121836.html
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