Search results for "chalcogen bonding"

showing 2 items of 2 documents

Intramolecular 1,5-S...N σ-hole interaction in (E)-N′-(pyridin-4-ylmethylidene)thiophene-2-carbohydrazide

2020

The hydrazide-hydrazone forms inverse dimers via hydrogen bonding, but its conformation is defined by the presence of an intra­molecular chalcogen bond. Electrostatic forces dominate in the crystal packing and give rise to a layered supra­molecular structure.

crystal structurehirshfeld surfaceDouble bondImineStackingCrystal structureCarbohydrazide010402 general chemistryRing (chemistry)01 natural sciencesResearch Communicationsenergy frameworkslcsh:Chemistrychemistry.chemical_compoundchalcogen bondingGeneral Materials Sciencechemistry.chemical_classificationQuantitative Biology::Biomoleculesintermolecular interaction energies010405 organic chemistryHydrogen bondGeneral Chemistryinter­molecular inter­action energieshydrogen bondingCondensed Matter Physics4-pyridinecarboxaldehyde 2-thienyl hydrazone0104 chemical sciencesCrystallographylcsh:QD1-999chemistry4-pyridine­carboxaldehyde 2-thienyl hydrazoneMonoclinic crystal systemActa Crystallographica Section E Crystallographic Communications
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The S … Hal and Se … Hal chalcogen bonding in a series of thiourea, selenourea and their derivatives

2021

The chalcogen bonding (ChB) in a series of thiourea, selenourea and their derivatives has been investigated in the present paper. Thus, selenourea and dimethylselenourea undergo dimerization and trimerization processes in the presence of various halogen species (1–5). Selenourea and dimethylselenourea form trimers 3–4 in the presence of lighter halogens (chlorine and bromine) through Se⋯Se chalcogen bonding. When moving to heavier halogen (iodine), the dimers 1–2 are formed. Thiourea and its derivatives also tend to make very strong S⋯S bonds and form dimers in the case of lighter halogens chlorine and bromine (compounds 6–7). However, the monomers separated by the iodine species are formed…

kemiaSelenoureachemistry.chemical_element02 engineering and technologyCrystal structure010402 general chemistry01 natural sciencesInorganic Chemistryjodichemistry.chemical_compoundChalcogenkemialliset sidoksetklooriPolymer chemistryMaterials ChemistryChlorinechalcogen bondingbromiPhysical and Theoretical ChemistryselenoureathioureaBrominehalogeenitChemistry021001 nanoscience & nanotechnologyCondensed Matter Physicshalogen0104 chemical sciencesElectronic Optical and Magnetic MaterialsMonomerThioureaHalogenCeramics and Composites0210 nano-technology
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