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The structural properties of a noncentrosymmetric polymorph of 4‐aminobenzoic acid
Authors:Rim Benali‐Cherif  Radhwane Takouachet  El‐Eulmi Bendeif  Nourredine Benali‐Cherif
Abstract:The crystal structure of a polymorph of 4‐aminobenzoic acid (PABA), C7H7NO2, at 100 K is noncentrosymmetric, as opposed to centrosymmetric in the structures of the other known polymorphs. The two crystallographically independent PABA molecules form pseudocentrosymmetric O—H...O hydrogen‐bonded dimers that are further linked by N—H...O hydrogen bonds into a three‐dimensional network. The benzene rings stack in the b direction. The CO2 moieties are bent out slightly from the benzene ring plane.
Keywords:crystal structure  4‐aminobenzoic acid  PABA  polymorphism  noncentrosymmetric polymorph  hydrogen bonding  pharmaceuticals
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