The slow magnetic relaxation in Dy-phthalocyanine single-molecule magnet induced by CH2Cl2 solvent molecules

Abstract

DyPc2 and DyPc2•CH2Cl2 were prepared using the solvent thermal method. The x-ray diffractometer and the Fourier transform infrared spectrometer were used to explore the structure changes between DyPc2 and DyPc2•CH2Cl2. The results clearly demonstrate that the CH2Cl2 molecule can alter the crystal structures and, thus, change the molecular stacking structures of DyPc2 without destroying molecular integrity. Geometry optimization further proved that DyPc2 belongs to the space group P212121, while DyPc2•CH2Cl2 crystallizes in the space group Pnma. It is clearly demonstrated that the different molecular environment affects the structure of a single DyPc2 molecule to some extent, such as the twist angles of two Pc rings and the Pc−Dy−Pc angles. The molar magnetic susceptibility and hysteresis loops for DyPc2 and DyPc2•CH2Cl2 were also measured and compared. The negative Weiss constants were obtained by the Curie−Weiss law fitting above 50 K. The hysteresis loop for DyPc2•CH2Cl2 is wider than that of DyPc2, implying that the magnetic relaxation of DyPc2 slowed down, while quantum tunneling of the magnetization is prevented efficiently after absorbing CH2Cl2 molecules. This work clarifies the correlation between the molecular environment and magnetism of single-molecule magnets, which is helpful for their design guideline and future applications.