Theory of Field-Dependent NMR Shifts in Paramagnetic Molecules NMR chemical shifts depend on the applied magnetic flux density, and this becomes more and more important as stronger and stronger magnetic fields are becoming available. Herein we develop a theory of...

🧲💥 Hot off the press! New theory shows how #NMR shifts in #paramagnetic molecules scale with magnetic field.
Two distinct theoretical approaches:
- Finite-field method
- Second-order method
This framework was tested on the NiSAL–HDPT complex. The result? Excellent agreement with experimental data!

Thanks to Yujie from Bob Griffin’s team, this manuscript also contains some of the first nutation and specialty EPR experiments for diboron diradicals. #EPR #paramagnetic #diradicals #maingroup #boron @gilliardgroup.bsky.social pubs.acs.org/doi/full/10....

Our manuscript on the first diboron-incorporated indenofluorenes is online in
@jacs.acspublications.org! Eric and coworkers report pentacyclic neutral, diradical, radical anion, and dianion ring systems w/18, 20, 21, and 22π electrons! #maingroup #boron #paramagnetic pubs.acs.org/doi/full/10....

Excellent Fe(II) Binding Tag in Protein Paramagnetic NMR Spectroscopy | Inorganic Chemistry pubs.acs.org/doi/10.1021/... Su and co-workers @InorgChem #iron #ferrous #paramagnetic #BindingTag #NMR #TDA