Spin density localization and accessibility of organic radicals affect liquid-state DNP efficiency

Phys Chem Chem Phys. 2021 Feb 28;23(8):4480-4485. doi: 10.1039/d0cp05796g. Epub 2021 Feb 18.

Abstract

We report a large variation in liquid DNP performance of up to a factor of about five in coupling factor among organic radicals commonly used as polarizing agents. A comparative study of 1H and 13C DNP in model systems shows the impact of the spin density distribution and accessibility of the radical site by the target molecule.