Mechanistic insights into the non-bifunctional hydrogenation of esters by Co(ii) pincer complexes: a DFT study

2019 ◽  
Vol 48 (42) ◽  
pp. 16083-16090 ◽  
Author(s):  
Animesh Chowdhury ◽  
Santu Biswas ◽  
Anup Pramanik ◽  
Pranab Sarkar
Keyword(s):  
Catalytic Hydrogenation ◽  
Dft Study ◽  
Pincer Complexes

Mechanistic details have been investigated for the catalytic hydrogenation of esters to alcohols by Co(ii) pincer complexes.

scholarly journals Highly selective hydrogenation of amides catalysed by a molybdenum pincer complex: scope and mechanism

2019 ◽  
Vol 10 (45) ◽  
pp. 10566-10576 ◽  
Author(s):  
Thomas Leischner ◽  
Lluis Artús Suarez ◽  
Anke Spannenberg ◽  
Kathrin Junge ◽  
Ainara Nova ◽  
...  
Keyword(s):  
Catalytic Hydrogenation ◽  
Selective Hydrogenation ◽  
Pincer Complexes ◽  
Pincer Complex ◽  
First Time

A series of molybdenum pincer complexes has been shown for the first time to be active in the catalytic hydrogenation of amides.

Efficient and selective catalytic hydrogenation of furanic aldehydes using well defined Ru and Ir pincer complexes

2020 ◽  
Vol 22 (20) ◽  
pp. 6767-6772
Author(s):  
Rosa Padilla ◽  
Sakhitha Koranchalil ◽  
Martin Nielsen
Keyword(s):  
Catalytic Hydrogenation ◽  
Pincer Complexes

Homogeneous catalyzed hydrogenation of furanic aldehydes to their corresponding alcohols using PNP complexes.

A DFT study unveils the secret of how H2 is activated in the N-formylation of amines with CO2 and H2 catalyzed by Ru(ii) pincer complexes in the absence of exogenous additives

2017 ◽  
Vol 53 (89) ◽  
pp. 12148-12151 ◽  
Author(s):  
Yu Lu ◽  
Zheyuan Liu ◽  
Jiandong Guo ◽  
Shuanglin Qu ◽  
Ruihua Zhao ◽  
...  
Keyword(s):  
Dft Study ◽  
Activation Mechanism ◽  
Pincer Complexes ◽  
Dft Computations

DFT computations unraveled a new H2 activation mechanism used by Ru(ii) pincer complexes to catalyze the N-formylation of amines with CO2 and H2 in the absence of external additives.

Effect of copper size and structure on catalytic hydrogenation of acetyl: A comparative DFT study

2019 ◽  
Vol 492 ◽  
pp. 843-848
Author(s):  
Xiuqin Dong ◽  
Tianfeng Ma ◽  
Qiao Liu ◽  
Yingzhe Yu ◽  
Minhua Zhang
Keyword(s):  
Catalytic Hydrogenation ◽  
Dft Study ◽  
Effect Of Copper ◽  
Size And Structure
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