Computational approach to molecular catalysis by 3d transition metals: challenges and opportunities
Computational chemistry provides a versatile toolbox for studying mechanistic details of
catalytic reactions and holds promise to deliver practical strategies to enable the rational in …
catalytic reactions and holds promise to deliver practical strategies to enable the rational in …
Carbon dioxide reduction with homogenous early transition metal complexes: Opportunities and challenges for developing CO2 catalysis
KA Grice - Coordination Chemistry Reviews, 2017 - Elsevier
The field of carbon dioxide reduction by homogeneous early transition complexes (groups 3–
7) is reviewed. Many reactions with CO 2 have been studied with late transition metal …
7) is reviewed. Many reactions with CO 2 have been studied with late transition metal …
Recent advances in cooperative activation of CO 2 and N 2 O by bimetallic coordination complexes or binuclear reaction pathways
The gaseous small molecules, CO2 and N2O, play important roles in climate change and
ozone layer depletion, and they hold promise as underutilized reagents and chemical …
ozone layer depletion, and they hold promise as underutilized reagents and chemical …
Carbon dioxide complexes: Bonding modes and synthetic methods
A Paparo, J Okuda - Coordination Chemistry Reviews, 2017 - Elsevier
A critical survey on the literature on CO 2 metal complexes is provided. A re-evaluation of all
known CO 2 complexes reveals the existence of several bonding modes, which have not …
known CO 2 complexes reveals the existence of several bonding modes, which have not …
Redox chemistry of discrete low-valent titanium complexes and low-valent titanium synthons
S Fortier, A Gomez-Torres - Chemical Communications, 2021 - pubs.rsc.org
Titanium is a versatile metal that has important applications in practical synthesis, though
this is typically limited to stoichiometric reactions or Lewis acid catalysis. Recently, interest …
this is typically limited to stoichiometric reactions or Lewis acid catalysis. Recently, interest …
Bonding in pentalene complexes and their recent applications
FGN Cloke, JC Green, AFR Kilpatrick… - Coordination Chemistry …, 2017 - Elsevier
Molecular orbital (MO) theory is used to describe the bonding in transition metal pentalene
complexes in a variety of its coordination modes. The various MO models account for …
complexes in a variety of its coordination modes. The various MO models account for …
Molecular Capacitors: Accessible 6-and 8-Electron Redox Chemistry from Dimeric “Ti (I)” and “Ti (0)” Synthons Supported by Imidazolin-2-Iminato Ligands
A Gomez-Torres, N Mavragani… - Inorganic …, 2022 - ACS Publications
Reduction of the diamagnetic Ti (III)/Ti (III) dimer [Cl2Ti (μ-NImDipp)] 2 (1)(NImDipp=[1, 3-bis
(Dipp) imidazolin-2-iminato]−, Dipp= C6H3-2, 6-i Pr2) with 4 and 6 equiv of KC8 generates …
(Dipp) imidazolin-2-iminato]−, Dipp= C6H3-2, 6-i Pr2) with 4 and 6 equiv of KC8 generates …
Dinitrogen functionalization with carbon dioxide and carbon disulfide giving symmetric and unsymmetric hydrazido complexes
Y Ishida, S Hasegawa… - Angewandte Chemie …, 2023 - Wiley Online Library
Here we show that a tridentate bis (aryloxide) anilide‐ligated titanium/potassium scaffold
promotes functionalization of coordinated N2 with CO2 and CS2 through formation of N− C …
promotes functionalization of coordinated N2 with CO2 and CS2 through formation of N− C …
Titanium and Zirconium Permethylpentalene Complexes, Pn*MCpRX, as Ethylene Polymerization Catalysts
DAX Fraser, ZR Turner, JC Buffet, D O'Hare - Organometallics, 2016 - ACS Publications
A family of group 4 permethylpentalene complexes, Pn* MCpRX (M= Ti, Zr; CpR= Cp, CpMe,
CptBu, CpnBu, CpMe3, Ind; X= Cl, Me), has been synthesized and fully characterized by …
CptBu, CpnBu, CpMe3, Ind; X= Cl, Me), has been synthesized and fully characterized by …
Trapping CS22– and S32– between Two Ytterbium Formamidinates
Treatment of [YbII (DippForm) 2 (thf) n](n= 2 (1aYb), n= 1 (1bYb); DippForm= N, N′-bis (2, 6-
diisopropylphenyl) formamidinate), with either excess CS2 or S8 gives [YbIII2 (DippForm) 4 …
diisopropylphenyl) formamidinate), with either excess CS2 or S8 gives [YbIII2 (DippForm) 4 …