{"id":"https://openalex.org/W2492749999","doi":"https://doi.org/10.1002/9781118898277.ch15","title":"High\u2010Spin and Low\u2010Spin States in {FeNO}7, FeIV=O, and FeIII\u2013OOH Complexes and Their Correlations to Reactivity","display_name":"High\u2010Spin and Low\u2010Spin States in {FeNO}7, FeIV=O, and FeIII\u2013OOH Complexes and Their Correlations to Reactivity","publication_year":2015,"publication_date":"2015-10-03","ids":{"openalex":"https://openalex.org/W2492749999","doi":"https://doi.org/10.1002/9781118898277.ch15","mag":"2492749999"},"language":"en","primary_location":{"id":"doi:10.1002/9781118898277.ch15","doi":"https://doi.org/10.1002/9781118898277.ch15","is_oa":false,"landing_page_url":"https://doi.org/10.1002/9781118898277.ch15","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Spin States in Biochemistry and Inorganic Chemistry","raw_type":"other"},"volume":{"id":"https://openalex.org/W4256085736","display_name":"Spin States in Biochemistry and Inorganic Chemistry"},"type":"other","indexed_in":["crossref"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5024342453","display_name":"Edward I. Solomon","orcid":"https://orcid.org/0000-0003-0291-3199","observed_orcids":["https://orcid.org/0000-0003-0291-3199"]},"institutions":[{"id":"https://openalex.org/I2801935854","display_name":"SLAC National Accelerator Laboratory","ror":"https://ror.org/05gzmn429","country_code":"US","type":"facility","lineage":["https://openalex.org/I1330989302","https://openalex.org/I2801935854","https://openalex.org/I39565521","https://openalex.org/I97018004"]},{"id":"https://openalex.org/I4210120900","display_name":"Stanford Synchrotron Radiation Lightsource","ror":"https://ror.org/02vzbm991","country_code":"US","type":"facility","lineage":["https://openalex.org/I1330989302","https://openalex.org/I2801935854","https://openalex.org/I39565521","https://openalex.org/I4210120900","https://openalex.org/I97018004"]},{"id":"https://openalex.org/I97018004","display_name":"Stanford University","ror":"https://ror.org/00f54p054","country_code":"US","type":"education","lineage":["https://openalex.org/I97018004"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Edward I. Solomon","raw_affiliation_strings":["Department of Chemistry, Stanford University, Stanford, CA, USA","Stanford Synchrotron Radiation Lightsource, SLAC National Accelerator Laboratory, Stanford University, Menlo Park, CA, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Stanford University, Stanford, CA, USA","institution_ids":["https://openalex.org/I97018004"]},{"raw_affiliation_string":"Stanford Synchrotron Radiation Lightsource, SLAC National Accelerator Laboratory, Stanford University, Menlo Park, CA, USA","institution_ids":["https://openalex.org/I2801935854","https://openalex.org/I4210120900","https://openalex.org/I97018004"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5032437080","display_name":"Kyle D. Sutherlin","orcid":"https://orcid.org/0000-0001-6958-4671","observed_orcids":["https://orcid.org/0000-0001-6958-4671"]},"institutions":[{"id":"https://openalex.org/I97018004","display_name":"Stanford University","ror":"https://ror.org/00f54p054","country_code":"US","type":"education","lineage":["https://openalex.org/I97018004"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Kyle D. Sutherlin","raw_affiliation_strings":["Department of Chemistry, Stanford University, Stanford, CA, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Stanford University, Stanford, CA, USA","institution_ids":["https://openalex.org/I97018004"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5076147652","display_name":"Martin Srnec","orcid":"https://orcid.org/0000-0001-5118-141X","observed_orcids":["https://orcid.org/0000-0001-5118-141X"]},"institutions":[{"id":"https://openalex.org/I202391551","display_name":"Czech Academy of Sciences","ror":"https://ror.org/053avzc18","country_code":"CZ","type":"government","lineage":["https://openalex.org/I202391551"]},{"id":"https://openalex.org/I4210127897","display_name":"Czech Academy of Sciences, Heyrovsky Institute","ror":"https://ror.org/02sat5y74","country_code":"CZ","type":"facility","lineage":["https://openalex.org/I202391551","https://openalex.org/I4210127897"]},{"id":"https://openalex.org/I97018004","display_name":"Stanford University","ror":"https://ror.org/00f54p054","country_code":"US","type":"education","lineage":["https://openalex.org/I97018004"]}],"countries":["CZ","US"],"is_corresponding":false,"raw_author_name":"Martin Srnec","raw_affiliation_strings":["Department of Chemistry, Stanford University, Stanford, CA, USA","J. Heyrovsky\u0301 Institute of Physical Chemistry, v.v.i., Czech Academy of Sciences, Prague, Czech Republic","J. Heyrovsk\u00fd Institute of Physical Chemistry, v.v.i., Czech Academy of Sciences, Prague, Czech Republic"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Stanford University, Stanford, CA, USA","institution_ids":["https://openalex.org/I97018004"]},{"raw_affiliation_string":"J. Heyrovsky\u0301 Institute of Physical Chemistry, v.v.i., Czech Academy of Sciences, Prague, Czech Republic","institution_ids":["https://openalex.org/I202391551","https://openalex.org/I4210127897"]},{"raw_affiliation_string":"J. Heyrovsk\u00fd Institute of Physical Chemistry, v.v.i., Czech Academy of Sciences, Prague, Czech Republic","institution_ids":["https://openalex.org/I202391551","https://openalex.org/I4210127897"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":null,"has_fulltext":false,"cited_by_count":1,"citation_normalized_percentile":null,"cited_by_percentile_year":null,"biblio":{"volume":null,"issue":null,"first_page":"369","last_page":"407"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11747","display_name":"Metal-Catalyzed Oxygenation Mechanisms","score":0.9945999979972839,"subfield":{"id":"https://openalex.org/subfields/1604","display_name":"Inorganic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11747","display_name":"Metal-Catalyzed Oxygenation Mechanisms","score":0.9945999979972839,"subfield":{"id":"https://openalex.org/subfields/1604","display_name":"Inorganic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11626","display_name":"Metalloenzymes and iron-sulfur proteins","score":0.002099999925121665,"subfield":{"id":"https://openalex.org/subfields/2105","display_name":"Renewable Energy, Sustainability and the Environment"},"field":{"id":"https://openalex.org/fields/21","display_name":"Energy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10612","display_name":"Magnetism in coordination complexes","score":0.00039999998989515007,"subfield":{"id":"https://openalex.org/subfields/2504","display_name":"Electronic, Optical and Magnetic Materials"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/high-spin-and-low-spin-states","display_name":"high-spin and low-spin states","score":0.8840000033378601},{"id":"https://openalex.org/keywords/iron-nitrosyl-complexes","display_name":"iron nitrosyl complexes","score":0.7870000004768372},{"id":"https://openalex.org/keywords/nonheme-iron-enzymes","display_name":"non-heme iron enzymes","score":0.8730000257492065},{"id":"https://openalex.org/keywords/magnetic-circular-dichroism","display_name":"magnetic circular dichroism","score":0.8259999752044678},{"id":"https://openalex.org/keywords/frontier-molecular-orbitals","display_name":"frontier molecular orbitals","score":0.9010000228881836},{"id":"https://openalex.org/keywords/h-atom-abstraction","display_name":"H-atom abstraction","score":0.843999981880188},{"id":"https://openalex.org/keywords/oxygen-atom-transfer","display_name":"oxygen atom transfer","score":0.9819999933242798}],"concepts":[{"id":"https://openalex.org/C2776910235","wikidata":"https://www.wikidata.org/wiki/Q18574","display_name":"Reactivity (psychology)","level":3,"score":0.8894660472869873},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7400561571121216},{"id":"https://openalex.org/C189394030","wikidata":"https://www.wikidata.org/wiki/Q53860","display_name":"Atomic orbital","level":3,"score":0.6320340037345886},{"id":"https://openalex.org/C139358910","wikidata":"https://www.wikidata.org/wiki/Q725417","display_name":"Molecular orbital","level":3,"score":0.5917478799819946},{"id":"https://openalex.org/C42704618","wikidata":"https://www.wikidata.org/wiki/Q910917","display_name":"Spin (aerodynamics)","level":2,"score":0.559738278388977},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.5146821141242981},{"id":"https://openalex.org/C68563686","wikidata":"https://www.wikidata.org/wiki/Q6731531","display_name":"Magnetic circular dichroism","level":3,"score":0.492570698261261},{"id":"https://openalex.org/C2777289219","wikidata":"https://www.wikidata.org/wiki/Q7632154","display_name":"Substrate (aquarium)","level":2,"score":0.46893027424812317},{"id":"https://openalex.org/C35325081","wikidata":"https://www.wikidata.org/wiki/Q7577416","display_name":"Spin states","level":2,"score":0.46159908175468445},{"id":"https://openalex.org/C4839761","wikidata":"https://www.wikidata.org/wiki/Q212111","display_name":"Spectral line","level":2,"score":0.2741336524486542},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.2274586260318756},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.19060468673706055},{"id":"https://openalex.org/C179104552","wikidata":"https://www.wikidata.org/wiki/Q11165","display_name":"Inorganic chemistry","level":1,"score":0.11946567893028259},{"id":"https://openalex.org/C1276947","wikidata":"https://www.wikidata.org/wiki/Q333","display_name":"Astronomy","level":1,"score":0.0},{"id":"https://openalex.org/C147120987","wikidata":"https://www.wikidata.org/wiki/Q2225","display_name":"Electron","level":2,"score":0.0},{"id":"https://openalex.org/C97355855","wikidata":"https://www.wikidata.org/wiki/Q11473","display_name":"Thermodynamics","level":1,"score":0.0},{"id":"https://openalex.org/C127313418","wikidata":"https://www.wikidata.org/wiki/Q1069","display_name":"Geology","level":0,"score":0.0},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.0},{"id":"https://openalex.org/C142724271","wikidata":"https://www.wikidata.org/wiki/Q7208","display_name":"Pathology","level":1,"score":0.0},{"id":"https://openalex.org/C204787440","wikidata":"https://www.wikidata.org/wiki/Q188504","display_name":"Alternative medicine","level":2,"score":0.0},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.0},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.0},{"id":"https://openalex.org/C111368507","wikidata":"https://www.wikidata.org/wiki/Q43518","display_name":"Oceanography","level":1,"score":0.0}],"mesh":[],"locations_count":2,"locations":[{"id":"doi:10.1002/9781118898277.ch15","doi":"https://doi.org/10.1002/9781118898277.ch15","is_oa":false,"landing_page_url":"https://doi.org/10.1002/9781118898277.ch15","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Spin States in Biochemistry and Inorganic Chemistry","raw_type":"other"},{"id":"pmh:oai:asep.lib.cas.cz:CavUnEpca/0472718","doi":null,"is_oa":false,"landing_page_url":"http://hdl.handle.net/11104/0269947","pdf_url":null,"source":{"id":"https://openalex.org/S7407055266","display_name":"ASEP","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":null,"raw_type":"info:eu-repo/semantics/bookPart"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320332161","display_name":"National Institutes of Health","ror":"https://ror.org/01cwqze88"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":85,"referenced_works":["https://openalex.org/W1492352549","https://openalex.org/W1509366823","https://openalex.org/W1554568866","https://openalex.org/W1654652909","https://openalex.org/W1967314547","https://openalex.org/W1969474820","https://openalex.org/W1971336871","https://openalex.org/W1971648746","https://openalex.org/W1972846946","https://openalex.org/W1974668849","https://openalex.org/W1975935952","https://openalex.org/W1977734848","https://openalex.org/W1979833573","https://openalex.org/W1981641123","https://openalex.org/W1983684033","https://openalex.org/W1985499128","https://openalex.org/W1986537300","https://openalex.org/W1988841674","https://openalex.org/W1988949059","https://openalex.org/W1989508750","https://openalex.org/W1995448194","https://openalex.org/W1995732169","https://openalex.org/W1995879115","https://openalex.org/W1995951784","https://openalex.org/W1997201299","https://openalex.org/W2001900976","https://openalex.org/W2006240727","https://openalex.org/W2009223752","https://openalex.org/W2010065309","https://openalex.org/W2011709963","https://openalex.org/W2011715467","https://openalex.org/W2013034718","https://openalex.org/W2013393709","https://openalex.org/W2015959646","https://openalex.org/W2017583902","https://openalex.org/W2020100815","https://openalex.org/W2022757946","https://openalex.org/W2023348316","https://openalex.org/W2028047546","https://openalex.org/W2029556357","https://openalex.org/W2029571935","https://openalex.org/W2035246177","https://openalex.org/W2035776875","https://openalex.org/W2040134741","https://openalex.org/W2043353505","https://openalex.org/W2045299448","https://openalex.org/W2047601015","https://openalex.org/W2047636928","https://openalex.org/W2048487207","https://openalex.org/W2050264954","https://openalex.org/W2052352527","https://openalex.org/W2057773123","https://openalex.org/W2062373493","https://openalex.org/W2068185427","https://openalex.org/W2074977613","https://openalex.org/W2077749836","https://openalex.org/W2078160714","https://openalex.org/W2089692551","https://openalex.org/W2090688899","https://openalex.org/W2092613782","https://openalex.org/W2096883213","https://openalex.org/W2096907657","https://openalex.org/W2097532911","https://openalex.org/W2100449328","https://openalex.org/W2104395874","https://openalex.org/W2105067416","https://openalex.org/W2107656141","https://openalex.org/W2117100299","https://openalex.org/W2121051087","https://openalex.org/W2125305445","https://openalex.org/W2142419145","https://openalex.org/W2142464470","https://openalex.org/W2147293395","https://openalex.org/W2149370026","https://openalex.org/W2160026651","https://openalex.org/W2161865042","https://openalex.org/W2167152315","https://openalex.org/W2172932477","https://openalex.org/W2319228641","https://openalex.org/W2324760790","https://openalex.org/W2338422154","https://openalex.org/W3155699657","https://openalex.org/W3217528490","https://openalex.org/W4229925216","https://openalex.org/W4234006259"],"related_works":["https://openalex.org/W2029556357","https://openalex.org/W2618846784","https://openalex.org/W2125305445","https://openalex.org/W2962374572","https://openalex.org/W2313134014","https://openalex.org/W1999760359","https://openalex.org/W2944328801","https://openalex.org/W3035799910","https://openalex.org/W7066254986","https://openalex.org/W1981060411"],"abstract_inverted_index":{"This":[0],"chapter":[1],"presents":[2],"a":[3],"detailed":[4],"discussion":[5],"of":[6,86,93,141],"high-spin":[7],"and":[8,22,45,51,58,77,107,129,137],"low-spin":[9],"states":[10],"in":[11,56,64,103,134,146],"(FeNO)7":[12],"(S":[13,18,24],"=":[14,19,25],"3/2,":[15],"1/2),":[16],"FeIV=O":[17,143],"2,":[20],"1),":[21],"FeIIIOOH":[23],"5/2,":[26],"1/2)":[27],"complexes,":[28],"their":[29,52],"frontier":[30],"molecular":[31,38],"orbitals":[32,39],"(FMOs,":[33],"that":[34],"is,":[35],"low-lying":[36],"unoccupied":[37],"(MOs)":[40],"with":[41,72],"proper":[42],"orbital":[43],"character":[44],"orientation":[46],"for":[47,80,101],"attack":[48],"on":[49],"substrate),":[50],"contributions":[53,124],"to":[54,114,125],"reactivity":[55,71,102,133,140],"model":[57],"enzyme":[59,144],"systems.":[60],"Five-coordinate":[61],"ferrous":[62],"sites":[63],"nonheme":[65],"Fe":[66],"enzymes":[67],"generally":[68],"have":[69],"low":[70],"O2":[73],"unless":[74],"both":[75],"substrate":[76],"cofactor":[78],"necessary":[79],"the":[81,87,94,98,122,135,138,142],"reaction":[82],"are":[83],"present.":[84],"Analysis":[85],"magnetic":[88],"circular":[89],"dichroism":[90],"(MCD)":[91],"spectra":[92],"models":[95,136],"has":[96,120],"elucidated":[97],"FMOs":[99],"available":[100],"each":[104],"spin":[105],"state,":[106],"nuclear":[108],"resonance":[109],"vibrational":[110],"spectroscopy":[111],"(NRVS)":[112],"coupled":[113],"density":[115],"functional":[116],"theory":[117],"(DFT)":[118],"calculations":[119],"defined":[121],"geometric":[123],"H-atom":[126],"abstraction":[127],"(HAA)":[128],"oxygen-atom":[130],"transfer":[131],"(OAT)":[132],"HAA":[139],"intermediate":[145],"syringomicyn":[147],"halogenase":[148],"(SyrB2).":[149]},"counts_by_year":[{"year":2025,"cited_by_count":1}],"updated_date":"2026-10-10T09:11:00.788812","created_date":"2016-08-23T00:00:00"}