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Information card for entry 1550237
Preview
Coordinates | 1550237.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 4-(1,1-diphenylethyl)-N,N-diethylaniline |
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Formula | C24 H27 N |
Calculated formula | C24 H27 N |
SMILES | c1(ccc(C(c2ccccc2)(c2ccccc2)C)cc1)N(CC)CC |
Title of publication | Au(i)-Catalyzed hydroarylation of alkenes with N,N-dialkylanilines: a dual gold catalysis concept |
Authors of publication | Abdellah, Ibrahim; Poater, Albert; Lohier, Jean-François; Gaumont, Annie-Claude |
Journal of publication | Catalysis Science & Technology |
Year of publication | 2018 |
Journal volume | 8 |
Journal issue | 24 |
Pages of publication | 6486 |
a | 8.3046 ± 0.0002 Å |
b | 10.7954 ± 0.0002 Å |
c | 12.0469 ± 0.0002 Å |
α | 109.64 ± 0.0009° |
β | 100.96 ± 0.0008° |
γ | 104.352 ± 0.0009° |
Cell volume | 940.16 ± 0.03 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0607 |
Residual factor for significantly intense reflections | 0.0456 |
Weighted residual factors for significantly intense reflections | 0.1194 |
Weighted residual factors for all reflections included in the refinement | 0.1296 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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