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Information card for entry 1559097
Preview
| Coordinates | 1559097.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H19 N |
|---|---|
| Calculated formula | C25 H19 N |
| SMILES | c12ccccc1c1ccccc1n2C(c1ccccc1)c1ccccc1 |
| Title of publication | Triarylborane catalysed N-alkylation of amines with aryl esters |
| Authors of publication | Nori, Valeria; Dasgupta, Ayan; Babaahmadi, Rasool; Carlone, Armando; Ariafard, Alireza; Melen, Rebecca L. |
| Journal of publication | Catalysis Science & Technology |
| Year of publication | 2020 |
| Journal volume | 10 |
| Journal issue | 22 |
| Pages of publication | 7523 - 7530 |
| a | 8.7417 ± 0.0005 Å |
| b | 11.0177 ± 0.0006 Å |
| c | 19.073 ± 0.0011 Å |
| α | 90° |
| β | 101.123 ± 0.006° |
| γ | 90° |
| Cell volume | 1802.48 ± 0.18 Å3 |
| Cell temperature | 199.9 ± 0.2 K |
| Ambient diffraction temperature | 199.9 ± 0.2 K |
| Number of distinct elements | 3 |
| 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 | 0.0689 |
| Residual factor for significantly intense reflections | 0.0509 |
| Weighted residual factors for significantly intense reflections | 0.1227 |
| Weighted residual factors for all reflections included in the refinement | 0.1331 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259601 (current) | 2020-12-06 | cif/ Updating files of 1559097, 1559098 Original log message: Adding full bibliography for 1559097--1559098.cif. |
1559097.cif |
| 256474 | 2020-09-17 | cif/ Adding structures of 1559097, 1559098 via cif-deposit CGI script. |
1559097.cif |
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Users of the data should acknowledge the original authors of the
structural data.