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Information card for entry 1571203
Preview
| Coordinates | 1571203.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Compound35 |
|---|---|
| Chemical name | Compound35 |
| Formula | C27 H24 N2 O P2 |
| Calculated formula | C27 H24 N2 O P2 |
| SMILES | P(=O)(CCP(=NC#N)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Electrosynthesis of iminophosphoranes and applications in nickel catalysis. |
| Authors of publication | Mdluli, Velabo; Lehnherr, Dan; Lam, Yu-Hong; Chaudhry, Mohammad T.; Newman, Justin A.; DaSilva, Jimmy O.; Regalado, Erik L. |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 16 |
| Pages of publication | 5980 - 5992 |
| a | 10.0468 ± 0.0002 Å |
| b | 10.5532 ± 0.0002 Å |
| c | 11.2334 ± 0.0002 Å |
| α | 81.121 ± 0.002° |
| β | 72.014 ± 0.002° |
| γ | 84.044 ± 0.002° |
| Cell volume | 1117.26 ± 0.04 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.036 |
| Residual factor for significantly intense reflections | 0.034 |
| Weighted residual factors for significantly intense reflections | 0.0866 |
| Weighted residual factors for all reflections included in the refinement | 0.0879 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 291567 (current) | 2024-05-05 | cif/ Updating files of 1571196, 1571197, 1571198, 1571199, 1571200, 1571201, 1571202, 1571203, 1571204 Original log message: Adding full bibliography for 1571196--1571204.cif. |
1571203.cif |
| 290414 | 2024-03-09 | cif/ Adding structures of 1571196, 1571197, 1571198, 1571199, 1571200, 1571201, 1571202, 1571203, 1571204 via cif-deposit CGI script. |
1571203.cif |
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Users of the data should acknowledge the original authors of the
structural data.