Synthesis, characterization and catalytic performances of benzimidazolin-2-iminato actinide (IV) complexes in the Tishchenko reactions for symmetrical and unsymmetrical esters
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Organometallic Chemistry"
DOI: 10.1016/j.jorganchem.2017.09.020
Abstract: Abstract A new family of benzimdazolin-2-iminato actinide−(IV) complexes [(Bim 7-Me Dipp/Me N)An(N(SiMe 3 ) 2 ) 3 ] (An = U ( 3 ), Th ( 4 )) and [(Bim 4-Me Dipp/Me N)An(N(SiMe 3 ) 2 )… read more here.
Keywords: characterization catalytic; catalytic performances; unsymmetrical esters; iminato actinide ... See more keywords
Theoretical Investigation of Catalytic Water Splitting by the Arene-Anchored Actinide Complexes.
Sign Up to like & getrecommendations! Published in 2022 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.2c01379
Abstract: Actinide complexes, which could enable the electrocatalytic H2O reduction, are not well documented because of the fact that actinide-containing catalysts are precluded by extremely stable actinyl species. Herein, by using relativistic density functional theory calculations,… read more here.
Keywords: arene anchored; investigation catalytic; arene; theoretical investigation ... See more keywords
Electron-Transfer-Enhanced Cation-Cation Interactions in Homo- and Heterobimetallic Actinide Complexes: A Relativistic Density Functional Theory Study.
Sign Up to like & getrecommendations! Published in 2018 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.8b00051
Abstract: To provide deep insight into cation-cation interactions (CCIs) involving hexavalent actinyl species that are major components in spent nuclear fuel and pose important implications for the effective removal of radiotoxic pollutants in the environment, a… read more here.
Keywords: cation; actinide; density; actinide complexes ... See more keywords
Actinide Complexes Possessing Six-Membered N-Heterocyclic Iminato Moieties: Synthesis and Reactivity
Sign Up to like & getrecommendations! Published in 2017 at "Organometallics"
DOI: 10.1021/acs.organomet.7b00037
Abstract: A novel class of ligand systems possessing a six-membered N-heterocyclic iminato [perimidin-2-iminato (PrRN, where R = isopropyl, cycloheptyl)] moiety is introduced. The complexation of these ligands with early actinides (An = Th and U) results… read more here.
Keywords: heterocyclic iminato; six membered; possessing six; membered heterocyclic ... See more keywords
Theoretical Study of Actinide Complexes with Macropa
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DOI: 10.1021/acsomega.0c02873
Abstract: The complex formation of actinium (Ac3+) and californium (Cf3+) ions with macropa (a promising ligand for medical applications, e.g., in targeted α therapy) has been studied by means of density functional theory (DFT) calculations. This… read more here.
Keywords: complexes macropa; study actinide; theoretical study; actinide complexes ... See more keywords
Porphyrinoid actinide complexes.
Sign Up to like & getrecommendations! Published in 2022 at "Chemical Society reviews"
DOI: 10.1039/d2cs00107a
Abstract: The diverse coordination modes and electronic features of actinide complexes of porphyrins and related oligopyrrolic systems (referred to as "porpyrinoids") have been the subject of interest since the 1960s. Given their stability and accessibility, most… read more here.
Keywords: actinide complexes; porphyrinoid actinide;
Assessment of Various Density Functional Theory Methods for Finding Accurate Structures of Actinide Complexes
Sign Up to like & getrecommendations! Published in 2022 at "Molecules"
DOI: 10.3390/molecules27051500
Abstract: Density functional theory (DFT) is a widely used computational method for predicting the physical and chemical properties of metals and organometals. As the number of electrons and orbitals in an atom increases, DFT calculations for… read more here.
Keywords: theory; functional theory; structures actinide; actinide complexes ... See more keywords