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Information card for entry 1555537
Preview
Coordinates | 1555537.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H39 Au2 F6 N O5 P2 S3 |
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Calculated formula | C46 H39 Au2 F6 N O5 P2 S3 |
SMILES | [Au]([S](c1ccccc1)[Au][P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.S(=O)(=O)(N=S([O-])(=O)C(F)(F)F)C(F)(F)F.O=C(OCC)C |
Title of publication | Gold-Catalyzed Anti-Markovnikov Selective Hydrothiolation of Unactivated Alkenes. |
Authors of publication | Tamai, Taichi; Fujiwara, Keiko; Higashimae, Shinya; Nomoto, Akihiro; Ogawa, Akiya |
Journal of publication | Organic letters |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 9 |
Pages of publication | 2114 - 2117 |
a | 14.011 ± 0.0003 Å |
b | 16.7528 ± 0.0003 Å |
c | 20.7802 ± 0.0004 Å |
α | 90° |
β | 105.001 ± 0.007° |
γ | 90° |
Cell volume | 4711.4 ± 0.2 Å3 |
Cell temperature | 123 K |
Ambient diffraction temperature | 123 K |
Number of distinct elements | 8 |
Space group number | 7 |
Hermann-Mauguin space group symbol | P 1 c 1 |
Hall space group symbol | P -2yc |
Residual factor for all reflections | 0.032 |
Residual factor for significantly intense reflections | 0.0294 |
Weighted residual factors for significantly intense reflections | 0.073 |
Weighted residual factors for all reflections included in the refinement | 0.0741 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
Diffraction radiation wavelength | 0.71075 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/1555537.html
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