A neutral crystalline imino-substituted silyl radical.

Fiona J KieferArseni Kostenko Richard Holzner Shigeyoshi Inoue

Published in: Chemical communications (Cambridge, England) (2024)

The neutral three-coordinated imino(silyl)silyl radical was isolated from the reaction of N-heterocyclic iminosilicon tribromide (I t BuN-SiBr 3 ) with NaSi t Bu 2 Me. The radical was fully characterized by X-ray crystallography and electron paramagnetic resonance spectroscopy and supported by quantum chemical calculations.

Keyphrases

molecular dynamics
high resolution
energy transfer
density functional theory
molecular docking
single molecule
monte carlo
magnetic resonance
solid state