Mechanistic insights into HCO <inf>2</inf> H dehydrogenation and CO <inf>2</inf> hydrogenation catalyzed by Ir(Cp*) containing tetrahydroxy bipyrimidine ligand: the role of sodium and proton shuttle
© The Royal Society of Chemistry. The mechanism of HCO 2 H dehydrogenation catalyzed by [IrCp*(H 2 O)(bpymO 4 H 4 )] 2+ (bpymO 4 H 4 = 2,2′,6,6′-tetrahydroxy-4,4′-bipyrimidine) was investigated using density functional theory. The relative free energy profiles at various protonation states correcte...
Saved in:
Main Authors: | , |
---|---|
Other Authors: | |
Format: | Article |
Published: |
2019
|
Subjects: | |
Online Access: | https://repository.li.mahidol.ac.th/handle/123456789/45517 |
Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Institution: | Mahidol University |