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Information card for entry 7713041
Preview
| Coordinates | 7713041.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H6 F17 N2 P |
|---|---|
| Calculated formula | C10 H6 F17 N2 P |
| SMILES | P(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)(F)(C(F)(C(F)(F)F)F)[n]1cn(C)cc1 |
| Title of publication | Anionic N-Heterocyclic Carbenes Featuring Weakly Coordinating Perfluoroalkylphosphorane Moieties |
| Authors of publication | Zapf, Ludwig; Radius, Udo; Finze, Maik |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 8.4857 ± 0.0001 Å |
| b | 11.6205 ± 0.0001 Å |
| c | 32.6317 ± 0.0002 Å |
| α | 90° |
| β | 90.467 ± 0.001° |
| γ | 90° |
| Cell volume | 3217.64 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| 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 | 0.0419 |
| Residual factor for significantly intense reflections | 0.0399 |
| Weighted residual factors for significantly intense reflections | 0.1071 |
| Weighted residual factors for all reflections included in the refinement | 0.1085 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.118 |
| 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 |
|---|---|---|---|
| 283796 (current) | 2023-05-16 | cif/ Adding structures of 7713041, 7713042, 7713043, 7713044, 7713045, 7713046, 7713047 via cif-deposit CGI script. |
7713041.cif |
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Users of the data should acknowledge the original authors of the
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