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Sen, Asmita, Britto, Neethinathan Johnee, Kass, Dustin, Ray, Kallol, Rajaraman, Gopalan (2024) Origin of Unprecedented Formation and Reactivity of FeIV═O Species via Oxygen Activation: Role of Noncovalent Interactions and Magnetic Coupling. Inorganic Chemistry, 63 (21) 9809-9822 doi:10.1021/acs.inorgchem.4c00371

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Reference TypeJournal (article/letter/editorial)
TitleOrigin of Unprecedented Formation and Reactivity of FeIV═O Species via Oxygen Activation: Role of Noncovalent Interactions and Magnetic Coupling
JournalInorganic Chemistry
AuthorsSen, AsmitaAuthor
Britto, Neethinathan JohneeAuthor
Kass, DustinAuthor
Ray, KallolAuthor
Rajaraman, GopalanAuthor
Year2024 (May 27)Volume63
Issue21
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/acs.inorgchem.4c00371Search in ResearchGate
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Mindat Ref. ID17418518Long-form Identifiermindat:1:5:17418518:7
GUID0
Full ReferenceSen, Asmita, Britto, Neethinathan Johnee, Kass, Dustin, Ray, Kallol, Rajaraman, Gopalan (2024) Origin of Unprecedented Formation and Reactivity of FeIV═O Species via Oxygen Activation: Role of Noncovalent Interactions and Magnetic Coupling. Inorganic Chemistry, 63 (21) 9809-9822 doi:10.1021/acs.inorgchem.4c00371
Plain TextSen, Asmita, Britto, Neethinathan Johnee, Kass, Dustin, Ray, Kallol, Rajaraman, Gopalan (2024) Origin of Unprecedented Formation and Reactivity of FeIV═O Species via Oxygen Activation: Role of Noncovalent Interactions and Magnetic Coupling. Inorganic Chemistry, 63 (21) 9809-9822 doi:10.1021/acs.inorgchem.4c00371
In(2024, May) Inorganic Chemistry Vol. 63 (21) American Chemical Society (ACS)

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Johnee Britto, Neethinathan, Sen, Asmita, Rajaraman, Gopalan (2025) Brønsted Acids as Direct C–H Bond Activators in Conjunction with High-Valent Metal–Oxo Catalysts: Revisiting Metal-Oxo Centered Mechanisms. Inorganic Chemistry, 64 (12). doi:10.1021/acs.inorgchem.4c04948
Sen, Asmita, Ansari, Mursaleem, Rajaraman, Gopalan (2023) Mechanism of Hydroboration of CO2 Using an Fe Catalyst: What Controls the Reactivity and Product Selectivity?. Inorganic Chemistry, 62 (9) 3727-3737 doi:10.1021/acs.inorgchem.2c02812
Ansari, Mursaleem, Senthilnathan, Dhurairajan, Rajaraman, Gopalan (2020) Deciphering the origin of million-fold reactivity observed for the open core diiron [HO–FeIII–O–FeIVO]2+species towards C–H bond activation: role of spin-states, spin-coupling, and spin-cooperation. Chemical Science, 11 (39) 10669-10687 doi:10.1039/d0sc02624g
Sen, Asmita, Ansari, Azaj, Swain, Abinash, Pandey, Bhawana, Rajaraman, Gopalan (2023) Probing the Origins of Puzzling Reactivity in Fe/Mn–Oxo/Hydroxo Species toward C–H Bonds: A DFT and Ab Initio Perspective. Inorganic Chemistry, 62 (37) 14931-14941 doi:10.1021/acs.inorgchem.3c01632
Malhotra, Vasu, Elvers, Benedict J., Dolai, Ramapada, Chrysochos, Nicolas, Bandaru, Siva Sankar Murthy, Gangber, Tejaswinee, Britto, Neethinathan Johnee, Krummenacher, Ivo, Rajaraman, Gopalan, Braunschweig, Holger, et al. (2024) Cross-Coupling of NHC/CAAC-Based Carbodicarbene: Synthesis of Electron-Deficient Diradicaloids. Journal of the American Chemical Society, 146 (43). doi:10.1021/jacs.4c08876
Johnee Britto, Neethinathan, Jaccob, Madhavan (2021) Deciphering the Mechanistic Details of Manganese-Catalyzed Formic Acid Dehydrogenation: Insights from DFT Calculations. Inorganic Chemistry, 60 (15) 11038-11047 doi:10.1021/acs.inorgchem.1c00757
Josephy, Thomas, Kumar, Ravi, Bleher, Katharina, Röhs, Fridolin, Glaser, Thorsten, Rajaraman, Gopalan, Comba, Peter (2024) Synthesis, Characterization, and Reactivity of Bispidine-Iron(IV)-Tosylimido Species. Inorganic Chemistry, 63 (26) 12109-12119 doi:10.1021/acs.inorgchem.4c01237
Dua, Purva, Sen, Asmita, Rajaraman, Gopalan (2024) Unravelling the Mechanism of CO2 Activation: Insights Into Metal‐Metal Cooperativity and Spin‐Orbit Coupling with {3d–4f} Catalysts. Chemistry – A European Journal, 30 (41) doi:10.1002/chem.202401796
Kumar, Ravi, Ansari, Azaj, Comba, Peter, Rajaraman, Gopalan (2024) Rebound or Cage Escape? The Role of the Rebound Barrier for the Reactivity of Non‐Heme High‐Valent FeIV=O Species. Chemistry – A European Journal, 30 (6) doi:10.1002/chem.202303300
Sen, Asmita, Rajaraman, Gopalan (2023) Does the Spin State and Oriented External Electric Field Boost the Efficiency of Fe(II) Pincer Catalyst toward CO2 Hydrogenation Reaction?. Inorganic Chemistry, 62 (5) 2342-2358 doi:10.1021/acs.inorgchem.2c04119
Gupta, Tulika, Beg, Mohammad Faizan, Rajaraman, Gopalan (2016) Role of Single-Ion Anisotropy and Magnetic Exchange Interactions in Suppressing Zero-Field Tunnelling in {3d-4f} Single Molecule Magnets. Inorganic Chemistry, 55 (21) 11201-11215 doi:10.1021/acs.inorgchem.6b01831
 
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