Showing results (1-10 of 6) with videos related to
Sort By:
Pageof 1
Physical Chemistry Chemical Physics : PCCP|April 8, 2024
Vibrational synchronization and its reaction pathway influence from an entropic intermediate in a dirhodium catalyzed allylic C-H activation/Cope rearrangement reactionAnthony J Schaefer, Daniel H EssChemical Science|October 20, 2025
Dynamics-based transition states reveal solvent cage effect and SN2 transition state motion in Lewis acid catalyzed stereoselective tertiary alcohol nucleophilic substitution reactionsAnthony J Schaefer, Trevor Mallavia, Daniel H EssJournal of Computational Chemistry|June 10, 2021
SEQCROW: A ChimeraX bundle to facilitate quantum chemical applications to complex molecular systemsAnthony J Schaefer, Victoria M Ingman, Steven E WheelerThe Journal of Physical Chemistry. A|June 5, 2024
Trajectory-Based Time-Resolved Mechanism for Benzene Reductive Elimination from Cyclopentadienyl Mo/W Phenyl Hydride ComplexesJoshua I Wheeler, Anthony J Schaefer, Daniel H EssJournal of the American Chemical Society|January 19, 2024
Dynamical Origin of Rebound versus Dissociation Selectivity during Fe-Oxo-Mediated C-H Functionalization ReactionsJyothish Joy, Anthony J Schaefer, Matthew S Teynor, et al.Chemical Science|October 25, 2024
Experimentally-based Fe-catalyzed ethene oligomerization machine learning model provides highly accurate prediction of propagation/termination selectivityBo Yang, Anthony J Schaefer, Brooke L Small, et al.Pageof 1