How does Lewis acid affect the reactivity of mononuclear high‐valent chromium–oxo species? A theoretical study

2021 ◽  
Author(s):  
Yunhee Choi ◽  
Bhawana Pandey ◽  
Xiao‐Xi Li ◽  
Yong‐Min Lee ◽  
Kyung‐Bin Cho ◽  
...  
Keyword(s):  
Lewis Acid ◽  
Theoretical Study ◽  
High Valent

scholarly journals Screening of different interactions in oxo-manganese porphyrin dimers containing axial N-donor ligands: a theoretical study

RSC Advances ◽  
2018 ◽  
Vol 8 (18) ◽  
pp. 9770-9774 ◽  
Author(s):  
Hossein Kavousi ◽  
Abdolreza Rezaeifard ◽  
Heidar Raeisi ◽  
Maasoumeh Jafarpour
Keyword(s):  
Theoretical Study ◽  
Donor Ligands ◽  
Manganese Porphyrin ◽  
High Valent ◽  
Porphyrin Dimers

A DFT analysis for describing the dimeric assemblies of high-valent manganese(v)-oxo meso-tetraphenylporphyrin ([(TPP)MnVO]22+) and meso-tetrakis(pentafluorophenyl)porphyrin ([(TPFPP)MnVO]22+) in the presence of axial N-donor ligands is presented.

scholarly journals Activation of a High-Valent Manganese–Oxo Complex by a Nonmetallic Lewis Acid

2014 ◽  
Vol 53 (12) ◽  
pp. 5893-5895 ◽  
Author(s):  
Regina A. Baglia ◽  
Maximilian Dürr ◽  
Ivana Ivanović-Burmazović ◽  
David P. Goldberg
Keyword(s):  
Lewis Acid ◽  
High Valent

scholarly journals Tuning the Geometric and Electronic Structure of Synthetic High-Valent Heme Iron(IV)-Oxo Models in the Presence of a Lewis Acid and Various Axial Ligands

2019 ◽  
Vol 141 (14) ◽  
pp. 5942-5960 ◽  
Author(s):  
Melanie A. Ehudin ◽  
Leland B. Gee ◽  
Sinan Sabuncu ◽  
Augustin Braun ◽  
Pierre Moënne-Loccoz ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Lewis Acid ◽  
Heme Iron ◽  
Axial Ligands ◽  
High Valent
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