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Information card for entry 7129984
Preview
| Coordinates | 7129984.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H26 F6 N P3 |
|---|---|
| Calculated formula | C34 H26 F6 N P3 |
| SMILES | P12(=N[P+](c3c2cccc3)(c2ccccc2)c2ccccc2)C(=CC=C1c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | A Cyclic Divalent N(I) Species Isoelectronic to Carbodiphosphoranes |
| Authors of publication | Tian, Jiaxin; Cordier, Marie; Bour, Christophe; Auffrant, Audrey; Gandon, Vincent |
| Journal of publication | Chemical Communications |
| Year of publication | 2022 |
| a | 8.2282 ± 0.0007 Å |
| b | 9.5081 ± 0.0008 Å |
| c | 10.7126 ± 0.0008 Å |
| α | 101.997 ± 0.002° |
| β | 91.033 ± 0.002° |
| γ | 111.831 ± 0.002° |
| Cell volume | 756.79 ± 0.11 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.0388 |
| Residual factor for significantly intense reflections | 0.0312 |
| Weighted residual factors for significantly intense reflections | 0.0739 |
| Weighted residual factors for all reflections included in the refinement | 0.0774 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.008 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274561 (current) | 2022-04-19 | cif/ Adding structures of 7129984 via cif-deposit CGI script. |
7129984.cif |
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Users of the data should acknowledge the original authors of the
structural data.