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Heavier chalcogenofenchones for fundamental gas-phase studies of molecular chirality

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arxiv 2506.09906 v1 pith:T2SZU72K submitted 2025-06-11 physics.chem-ph

Heavier chalcogenofenchones for fundamental gas-phase studies of molecular chirality

classification physics.chem-ph
keywords studieschiralitycompoundsfundamentalgas-phaseheaviermolecularaccessible
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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Monoterpene ketones are frequently studied compounds that enjoy great popularity both in chemistry and in physics due to comparatively high volatility, stability, conformational rigidity and commercial availability. Herein, we explore the heavier chalcogenoketone derivatives of fenchone as promising benchmark systems -- synthetically accessible in enantiomerically pure form -- for systematic studies of nuclear charge ($Z$) dependent properties in chiral compounds. Synthesis, structural characterization, thorough gas-phase rotational and vibrational spectroscopy as well as accompanying quantum chemical studies on the density-functional-theory level reported in this work foreshadow subsequent applications of this compound class for fundamental investigations of molecular chirality under well-defined conditions.

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