Molecular Magnetic Susceptibility Tensor in Sulfur Dioxide

Abstract

The diagonal elements in the magnetic susceptibility tensor in the principal molecule-fixed inertial axis system in SO2 have been determined by observing the molecular rotational Zeeman effect with a high-resolution microwave spectrometer. The signs of gaa, gbb, gcc have been found to be negative from theroetical considerations. The principal values of the magnetic susceptibility tensor, paramagnetic susceptibility tensor, and diamagnetic susceptibility tensor are, respectively: χaa = − 14.4 ± 1.2, χbb = − 19.6 ± 0.5, χcc = − 20.6 ± 0.6; χaap = 38.9 ± 0.3, χbbp = 129.3 ± 1.4, χccp = 139.5 ± 1.2; χaad = − 53.3 ± 1.2, χbbd = − 148.9 ± 1.5, χccd = − 160.1 ± 1.3 (all in units of 10−6 erg/G2·mole). The ground-state averages of the sum of the squares of the electronic coordinates, and approximate values of the diagonal components of the quadrupole moment tensor have also been determined.