Abstract
The reaction of chlorosulfonyl isocyanate (ClSO2NCO) with anhydrous hydrogen fluoride (aHF) leads to the formation of ClSO2NHC(O)F. The title compound with a melting point of -38 degrees C is characterized by vibrational spectroscopy and a single crystal structure analysis. It crystallizes in the tetragonal space group I4(1)/a with 16 formula units per unit cell. a = 11.1115(2) angstrom, c = 16.5654(6) angstrom. The experimental data are supported by quantum-chemical calculations on the PBE1PBE/6-311G(3pd,3df) level of theory.
| Dokumententyp: | Zeitschriftenartikel |
|---|---|
| Fakultät: | Chemie und Pharmazie > Department Chemie |
| Themengebiete: | 500 Naturwissenschaften und Mathematik > 540 Chemie |
| ISSN: | 0044-2313 |
| Sprache: | Englisch |
| Dokumenten ID: | 67374 |
| Datum der Veröffentlichung auf Open Access LMU: | 19. Jul. 2019, 12:22 |
| Letzte Änderungen: | 04. Nov. 2020, 13:49 |
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