{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,11,3]],"date-time":"2026-11-03T04:34:33Z","timestamp":1793680473625,"version":"4.5.1"},"reference-count":39,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2024,11,1]],"date-time":"2024-11-01T00:00:00Z","timestamp":1730419200000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2024,11,1]],"date-time":"2024-11-01T00:00:00Z","timestamp":1730419200000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2024,8,19]],"date-time":"2024-08-19T00:00:00Z","timestamp":1724025600000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Journal of Inorganic Biochemistry"],"published-print":{"date-parts":[[2024,11]]},"DOI":"10.1016\/j.jinorgbio.2024.112698","type":"journal-article","created":{"date-parts":[[2024,8,15]],"date-time":"2024-08-15T22:32:04Z","timestamp":1723761124000},"page":"112698","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":3,"special_numbering":"C","title":["Role of non-redox innocent ligand units in the oxidation of alcohols with H2O2 catalyzed by \u03bc-oxido-diiron(III) bis-phenolato polypyridyl complexes"],"prefix":"10.1016","volume":"260","author":[{"given":"Duenpen","family":"Unjaroen","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Dani\u00ebl R.","family":"Duijnstee","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Marika Di Berto","family":"Mancini","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Juan","family":"Chen","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ronald","family":"Hage","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Marcel","family":"Swart","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Wesley R.","family":"Browne","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.jinorgbio.2024.112698_bb0005","doi-asserted-by":"crossref","first-page":"2239","DOI":"10.1021\/cr9500390","article-title":"Structural and functional aspects of metal sites in biology","volume":"96","author":"Holm","year":"1996","journal-title":"Chem. Rev."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0010","doi-asserted-by":"crossref","first-page":"2165","DOI":"10.1021\/ja0036110","article-title":"Effects of metal ions on physicochemical properties and redox reactivity of phenolates and phenoxyl radicals: mechanistic insight into hydrogen atom abstraction by phenoxyl radical-metal complexes","volume":"123","author":"Itoh","year":"2001","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0015","doi-asserted-by":"crossref","first-page":"60","DOI":"10.4236\/ampc.2013.31A009","article-title":"Recent advances in X-ray structures of metal-phenoxyl radical complexes","volume":"03","author":"Shimazaki","year":"2013","journal-title":"Adv. Mater. Phys. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0020","doi-asserted-by":"crossref","first-page":"528","DOI":"10.1016\/j.ccr.2012.06.003","article-title":"Recent advances in phenoxyl radical complexes of salen-type ligands as mixed-valent galactose oxidase models","volume":"257","author":"Lyons","year":"2013","journal-title":"Coord. Chem. Rev."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0025","doi-asserted-by":"crossref","first-page":"2347","DOI":"10.1021\/cr020425z","article-title":"Free radical catalysis by galactose oxidase","volume":"103","author":"Whittaker","year":"2003","journal-title":"Chem. Rev."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0030","doi-asserted-by":"crossref","first-page":"2661","DOI":"10.1021\/cr980059c","article-title":"Protein radicals in enzyme catalysis","volume":"98","author":"Stubbe","year":"1998","journal-title":"Chem. Rev."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0035","doi-asserted-by":"crossref","first-page":"8217","DOI":"10.1021\/ja9700663","article-title":"Synthetic models of the inactive copper(II)-tyrosinate and active copper(II)-tyrosyl radical forms of galactose and glyoxal oxidases","volume":"119","author":"Halfen","year":"1997","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0040","doi-asserted-by":"crossref","first-page":"531","DOI":"10.1070\/RC2005v074n06ABEH000977","article-title":"Metal complexes with non-innocent ligands","volume":"74","author":"Butin","year":"2005","journal-title":"Russ. Chem. Rev."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0045","series-title":"Spin States in Biochemistry and Inorganic Chemistry","first-page":"229","author":"Heims","year":"2015"},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0050","doi-asserted-by":"crossref","first-page":"11222","DOI":"10.1021\/ja00077a022","article-title":"(Photo)ionization of tris(phenolato)iron(III) complexes: generation of phenoxyl radical as ligand","volume":"115","author":"Hockertz","year":"1993","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0055","series-title":"Prog. Inorg. Chem","doi-asserted-by":"crossref","first-page":"151","DOI":"10.1002\/0471227110.ch2","volume":"vol. 50","author":"Chaudhuri","year":"2001"},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0060","doi-asserted-by":"crossref","first-page":"537","DOI":"10.1126\/science.279.5350.537","article-title":"Catalytic galactose oxidase models: biomimetic Cu(II)-phenoxyl-radical reactivity","volume":"279","author":"Wang","year":"1998","journal-title":"Science"},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0065","doi-asserted-by":"crossref","first-page":"2217","DOI":"10.1002\/(SICI)1521-3773(19980904)37:16<2217::AID-ANIE2217>3.0.CO;2-D","article-title":"From structural models of galactose oxidase to homogeneous catalysis: efficient aerobic oxidation of alcohols","volume":"37","author":"Chaudhuri","year":"1998","journal-title":"Angew. Chem. Int. Ed."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0070","doi-asserted-by":"crossref","first-page":"1545","DOI":"10.1021\/ja411376u","article-title":"Spectroscopic and theoretical investigation of a complex with an [O=FeIV\u2013O\u2013FeIV=O] core related to methane monooxy-genase intermediate Q","volume":"136","author":"Stoian","year":"2014","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0075","doi-asserted-by":"crossref","first-page":"3976","DOI":"10.1021\/ic3027896","article-title":"Hydrogen-bonding effects on the reactivity of [X\u2013FeIII\u2013O\u2013FeIV=O] (X = OH, F) complexes toward C\u2013H bond cleavage","volume":"52","author":"Xue","year":"2013","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0080","doi-asserted-by":"crossref","first-page":"2393","DOI":"10.1021\/ic202379b","article-title":"Evaluating the identity and diiron core transformations of a (\u03bc-oxo)diiron(III) complex supported by electron-rich tris(pyridyl-2-methyl)amine ligands","volume":"51","author":"Do","year":"2012","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0085","doi-asserted-by":"crossref","first-page":"10417","DOI":"10.1021\/ic301642w","article-title":"Protonation of a peroxodiiron(III) complex and conversion to a diiron(III\/IV) intermediate: implications for proton-assisted O\u2013O bond cleavage in nonheme diiron enzymes","volume":"51","author":"Cranswick","year":"2012","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0090","doi-asserted-by":"crossref","first-page":"8310","DOI":"10.1021\/ic100870v","article-title":"Electron paramagnetic resonance, and density functional theory studies of synthetic S = 12 FeIII-O-FeIV=O complexes. superexchange-mediated spin transition at the FeIV=O site","volume":"49","author":"De Hont","year":"2010","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0095","doi-asserted-by":"crossref","first-page":"3067","DOI":"10.1021\/ic030296k","article-title":"A structural and M\u00f6ssbauer study of complexes with FeII(\u03bc-O(H))2 cores: stepwise oxidation from FeII(\u03bc-OH)2FeII through FeII(\u03bc-OH)2FeIII to FeIII(\u03bc-O)(\u03bc-OH)FeIII","volume":"43","author":"Stubna","year":"2004","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0100","article-title":"Chemoselective and biomimetic hydroxylation of hydrocarbons by non-heme \u03bc-oxo-bridged diiron(III) catalysts using m-CPBA as oxidant","volume":"5101\u20135114","author":"Mayilmurugan","year":"2009","journal-title":"Dalton Trans."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0105","doi-asserted-by":"crossref","first-page":"385","DOI":"10.1039\/b009368h","article-title":"Efficient catalytic oxidation of primary and secondary alcohols using a non-heme dinuclear iron complex","author":"Ligtenbarg","year":"2001","journal-title":"Chem. Commun."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0110","doi-asserted-by":"crossref","first-page":"2579","DOI":"10.1039\/dt9960002579","article-title":"Formation and reactivity of a peroxide adduct of iron(III) complexes containing substituted phenol derivatives","author":"Ito","year":"1996","journal-title":"J. Chem. Soc. Dalton Trans."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0115","doi-asserted-by":"crossref","first-page":"470","DOI":"10.1021\/acs.inorgchem.6b02378","article-title":"Electrochemical polymerization of iron(III) polypyridyl complexes through C\u2013C coupling of redox non-innocent phenolato ligands","volume":"56","author":"Unjaroen","year":"2017","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0120","doi-asserted-by":"crossref","first-page":"5222","DOI":"10.1021\/ja00223a068","article-title":"A model for the chromophoric site of purple acid phosphatases","volume":"110","author":"Yan","year":"1988","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0125","doi-asserted-by":"crossref","first-page":"2003","DOI":"10.1039\/jr9590002003","article-title":"The determination of the paramagnetic susceptibility of substances in solution by nuclear magnetic resonance","author":"Evans","year":"1959","journal-title":"J. Chem. Soc. (Resumed)"},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0130","doi-asserted-by":"crossref","first-page":"62","DOI":"10.1021\/ed069p62.1","article-title":"Utilizing the Evans method with a superconducting NMR spectrometer in the undergraduate laboratory","volume":"69","author":"Schubert","year":"1992","journal-title":"J. Chem. Ed."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0135","doi-asserted-by":"crossref","first-page":"5364","DOI":"10.1039\/C6CY00477F","article-title":"Iron amino-bis(phenolate) complexes for the formation of organic carbonates from CO2 and oxiranes","volume":"6","author":"Alhashmialameer","year":"2016","journal-title":"Cat. Sci. Technol."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0140","doi-asserted-by":"crossref","first-page":"13494","DOI":"10.1021\/acs.inorgchem.8b02109","article-title":"Characterization of oxo-bridged iron amino-bis(phenolate) complexes formed intentionally or in situ: mechanistic insight into epoxide deoxygenation during the coupling of CO2 and epoxides","volume":"57","author":"Andrea","year":"2018","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0145","doi-asserted-by":"crossref","first-page":"4211","DOI":"10.1021\/acs.inorgchem.5b02976","article-title":"Conflicting role of water in the activation of H2O2 and the formation and reactivity of non-Heme FeIII\u2013OOH and FeIII\u2013O\u2013FeIII complexes at room temperature","volume":"55","author":"Padamati","year":"2016","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0150","doi-asserted-by":"crossref","first-page":"1929","DOI":"10.1021\/ic980983p","article-title":"Iron chemistry of a pentadentate ligand that generates a metastable FeIIIOOH intermediate","volume":"38","author":"Roelfes","year":"1999","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0155","doi-asserted-by":"crossref","first-page":"931","DOI":"10.1002\/jcc.1056","article-title":"Chemistry with ADF","volume":"22","author":"Te Velde","year":"2001","journal-title":"J. Comput. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0160","series-title":"Theoretical Chemistry","author":"Baerends","year":"2023"},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0165","doi-asserted-by":"crossref","first-page":"166","DOI":"10.1016\/j.cplett.2013.06.045","article-title":"A new family of hybrid density functionals","volume":"580","author":"Swart","year":"2013","journal-title":"Chem. Phys. Lett."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0170","doi-asserted-by":"crossref","DOI":"10.1063\/1.3382344","article-title":"A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu","volume":"132","author":"Grimme","year":"2010","journal-title":"J. Chem. Phys."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0175","doi-asserted-by":"crossref","first-page":"1142","DOI":"10.1002\/jcc.10255","article-title":"Optimized Slater-type basis sets for the elements 1\u2013118","volume":"24","author":"Van Lenthe","year":"2003","journal-title":"J. Comput. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0180","doi-asserted-by":"crossref","first-page":"799","DOI":"10.1039\/P29930000799","article-title":"COSMO: a new approach to dielectric screening in solvents with explicit expressions for the screening energy and its gradient","volume":"2","author":"Klamt","year":"1993","journal-title":"J. Chem. Soc. Perkin Trans."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0185","first-page":"396","article-title":"An implementation of the conductor-like screening model of solvation within the Amsterdam density functional package","volume":"101","author":"Pye","year":"1999","journal-title":"Theor. ChemAcc"},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0190","doi-asserted-by":"crossref","first-page":"3646","DOI":"10.1002\/ejic.200700228","article-title":"Proton affinities in water of maingroup-element hydrides \u2013 effects of hydration and methyl substitution","volume":"2007","author":"Swart","year":"2007","journal-title":"Eur. J. Inorg. Chem."},{"key":"10.1016\/j.jinorgbio.2024.112698_bb0195","doi-asserted-by":"crossref","first-page":"2690","DOI":"10.1021\/acs.accounts.6b00271","article-title":"Spinning around in transition-metal chemistry","volume":"49","author":"Swart","year":"2016","journal-title":"Acc. Chem. Res."}],"container-title":["Journal of Inorganic Biochemistry"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0162013424002228?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0162013424002228?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2025,3,15]],"date-time":"2025-03-15T08:42:19Z","timestamp":1742028139000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0162013424002228"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2024,11]]},"references-count":39,"alternative-id":["S0162013424002228"],"URL":"https:\/\/doi.org\/10.1016\/j.jinorgbio.2024.112698","relation":{},"ISSN":["0162-0134"],"issn-type":[{"value":"0162-0134","type":"print"}],"subject":[],"published":{"date-parts":[[2024,11]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Role of non-redox innocent ligand units in the oxidation of alcohols with H2O2 catalyzed by \u03bc-oxido-diiron(III) bis-phenolato polypyridyl complexes","name":"articletitle","label":"Article Title"},{"value":"Journal of Inorganic Biochemistry","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.jinorgbio.2024.112698","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2024 The Authors. Published by Elsevier Inc.","name":"copyright","label":"Copyright"}],"article-number":"112698"}}