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Information card for entry 7714498
Preview
| Coordinates | 7714498.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C2 H3 F9 N O Sb |
|---|---|
| Calculated formula | C2 H3 F9 N O Sb |
| SMILES | [Sb](F)(F)(F)(F)(F)[F-].NC(=[OH+])C(F)(F)F |
| Title of publication | Synthesis and characterization of trifluoromethylcarboxonium salts. |
| Authors of publication | Saal, Thomas; Haiges, Ralf; Christe, Karl O. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2023 |
| a | 11.4747 ± 0.0012 Å |
| b | 10.4829 ± 0.0011 Å |
| c | 13.1367 ± 0.0013 Å |
| α | 90° |
| β | 94.205 ± 0.002° |
| γ | 90° |
| Cell volume | 1575.9 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0133 |
| Residual factor for significantly intense reflections | 0.0127 |
| Weighted residual factors for significantly intense reflections | 0.0321 |
| Weighted residual factors for all reflections included in the refinement | 0.0324 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.289 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287680 (current) | 2023-11-18 | cif/ Adding structures of 7714498, 7714499 via cif-deposit CGI script. |
7714498.cif |
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