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Information card for entry 1570631
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Coordinates | 1570631.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C17 H19 N O2 |
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Calculated formula | C17 H19 N O2 |
Title of publication | Efficient iron-catalyzed direct acylation of amines with carboxylic acids and esters under oxygenated conditions |
Authors of publication | Obieta, Maria; Urgoitia, Garazi; Herrero, María Teresa; SanMartin, Raul |
Journal of publication | Catalysis Science & Technology |
Year of publication | 2024 |
Journal volume | 14 |
Journal issue | 2 |
Pages of publication | 478 - 488 |
a | 5.4042 ± 0.0001 Å |
b | 22.6075 ± 0.0004 Å |
c | 23.7568 ± 0.0004 Å |
α | 90° |
β | 95.144 ± 0.002° |
γ | 90° |
Cell volume | 2890.81 ± 0.09 Å3 |
Cell temperature | 170 ± 0.1 K |
Ambient diffraction temperature | 170 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0704 |
Residual factor for significantly intense reflections | 0.0601 |
Weighted residual factors for significantly intense reflections | 0.1633 |
Weighted residual factors for all reflections included in the refinement | 0.1738 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.131 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1570631.html
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Users of the data should acknowledge the original authors of the
structural data.