The Na-O bond in sodium fenamate

Abstract

The one-dimensional polymeric structure of sodium diaquafenamate-water (1/1) was studied by X-ray diffraction. The sodium cation is coordinated to one oxygen atom of the carboxylate group and to four water oxygen atoms. To characterize the Na-O bonds, the quantum theory of atoms in molecules (QTAIM) and noncovalent interaction (NCI) approaches have been used. Both methods confirmed that the Na-O bonds are very weak, comparable with the weak N-H...O intramolecular hydrogen bond. The polymeric structure is stabilized by the interaction of the sodium cation with the surrounding water molecules.

Keywords: Na—O bond; noncovalent interaction (NCI) approach; quantum theory of atoms in molecules (QTAIM); sodium fenamate.