An article Inter- and Intramolecular Aryl-Aryl Interactions in Partially Fluorinated Ethylenedioxy-bridged Bisarenes** WOS:000581115000001 published article about PI-PI INTERACTIONS; ELECTRON-DIFFRACTION; LONDON DISPERSION; CRYSTAL-STRUCTURE; BENZENE; STACKING; HEXAFLUOROBENZENE; 1,8-DIARYLNAPHTHALENES; SYSTEMS; PHASE in [Weddeling, Jan-Henrik; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W.] Univ Bielefeld, Lehrstuhl Anorgan Chem & Strukturchem, Fak Chem, Univ Str 25, D-33615 Bielefeld, Germany in 2020, Cited 55. The Name is Anthrone. Through research, I have a further understanding and discovery of 90-44-8. Application In Synthesis of Anthrone
Several ethylenedioxy-bridged bisarenes with a variety of type and number of aryl groups were synthesized to study non-covalent dispersion-driven inter- and intramolecular aryl-aryl interactions in the solid state and gas phase. Intramolecular interactions are preferably found in the gas phase. DFT calculations with and without dispersion correction show larger interacting aromatic groups increase the stabilization energy of folded conformers and decrease the intermolecular centroid-centroid distance. Single-molecule structures generally adopt folded conformations with short intramolecular aryl-aryl contacts. Gas electron diffraction experiments were performed exemplarily for 1-(pentafluorophenoxy)-2-(phenoxy)ethane. A new procedure for structure refinement was developed to deal with the conformational complexity of such molecules. The results are an experimental confirmation of the existence of folded conformations of this molecule with short intramolecular aryl-aryl distances in the gas phase. Solid-state structures are dominated by stretched structures without intramolecular aryl-aryl interactions but interactions with neighboring molecules.
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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem