Disulfuryl Dichloride ClSO2OSO2Cl: A Conformation and Polymorphism Chameleon

作者：Betancourt Angelica Moreno; Schwabedissen Jan; Romano Rosana M^*; Della Vedova Carlos O; Beckers Helmut; Willner Helge; Stammler Hans Georg; Mitzel Norbert W^*

来源：Chemistry - A European Journal, 2018, 24(41): 10409-10421.

DOI：10.1002/chem.201800817

• disulfuryl dichloride
• gas-phase electron diffraction
• in situ crystallization
• matrix-isolation vibrational spectroscopy
• solid-state modifications

Disulfuryl dichloride ClSO2OSO2Cl was characterized by vibrational spectroscopy in the gaseous and liquid phase as well as in the Ar-matrix. By varying the temperature, certain bands could be assigned to several conformers. Gas-phase electron diffraction revealed a dominance of the anti-conformer at ambient temperature. The same conformation was found in the solid state. Via the in situ technique for crystallization, not less than four different modifications were identified. Among these different modifications, the structural parameters of the molecules remain relatively constant, but the aggregation pattern changes. Although the molecules aggregate by chlorineoxygen contacts in each modification, the geometrical parameters of these interaction show significant differences and were evaluated and are in part inconsistent with the halogen bonding concept.

• 出版日期2018-7-20