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Competition and interplay between Hydrogen, Tetrel, and Halogen bonds from interactions of COCl2 and HX (X = F, Cl, Br, and I)

Mohammadmehdi Moradkhani, Ali Naghipour, Yunes Abbasi Tyula

2023Computational and Theoretical Chemistry17 citationsDOI

Topics & Concepts

ChemistryHalogenNatural bond orbitalElectronegativityHalogen bondHydrogen bondAtoms in moleculesComputational chemistryMoleculeAtom (system on chip)CrystallographyHydrogenDensity functional theoryOrganic chemistryAlkylEmbedded systemComputer scienceCrystallography and molecular interactionsInorganic Fluorides and Related CompoundsMolecular Spectroscopy and Structure
Competition and interplay between Hydrogen, Tetrel, and Halogen bonds from interactions of COCl2 and HX (X = F, Cl, Br, and I) | Litcius