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Information card for entry 7037374
Preview
Coordinates | 7037374.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H18 F N |
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Calculated formula | C23 H18 F N |
SMILES | Fc1ccc(N(/C(=C/C#Cc2ccccc2)c2ccccc2)C)cc1 |
Title of publication | Hydroamination of diphenylbutadiyne with secondary N-methyl-anilines using the dipotassium tetrakis(2,6-diisopropylanilino)calciate precatalyst. |
Authors of publication | Younis, Fadi M.; Krieck, Sven; Görls, Helmar; Westerhausen, Matthias |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 14 |
Pages of publication | 6241 - 6250 |
a | 7.2846 ± 0.0001 Å |
b | 23.2679 ± 0.0005 Å |
c | 10.5794 ± 0.0002 Å |
α | 90° |
β | 98.835 ± 0.001° |
γ | 90° |
Cell volume | 1771.9 ± 0.06 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0416 |
Residual factor for significantly intense reflections | 0.0385 |
Weighted residual factors for significantly intense reflections | 0.0891 |
Weighted residual factors for all reflections included in the refinement | 0.0912 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
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/7037374.html
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