{"id":"https://openalex.org/W336327293","doi":null,"title":"Fluorine-Substituted Phenols as Probes to Study Intermolecular Proton Transfer Induced by Excess Electron Attachment to Uracil-Phenol Complexes #","display_name":"Fluorine-Substituted Phenols as Probes to Study Intermolecular Proton Transfer Induced by Excess Electron Attachment to Uracil-Phenol Complexes #","publication_year":2003,"publication_date":"2003-01-01","ids":{"openalex":"https://openalex.org/W336327293","mag":"336327293"},"language":"en","primary_location":{"id":"pmh:oai:CiteSeerX.psu:10.1.1.625.9169","doi":null,"is_oa":false,"landing_page_url":"http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.625.9169","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"http://biochempress.com/Files/IECMD_2003/IECMD_2003_011.pdf","raw_type":"text"},"volume":null,"type":"article","is_traditional":true,"indexed_in":[],"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/A5047178361","display_name":"BioChem Press","orcid":null,"observed_orcids":[]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"BioChem Press","raw_affiliation_strings":[],"raw_orcid":null,"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5087086361","display_name":"Maciej Hara","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I142606810","display_name":"Pacific Northwest National Laboratory","ror":"https://ror.org/05h992307","country_code":"US","type":"facility","lineage":["https://openalex.org/I1325736334","https://openalex.org/I1330989302","https://openalex.org/I142606810","https://openalex.org/I39565521"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Maciej Hara","raw_affiliation_strings":["Pacific Northwest National Laboratory"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Pacific Northwest National Laboratory","institution_ids":["https://openalex.org/I142606810"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5066003255","display_name":"Maciej S. Gutowski","orcid":"https://orcid.org/0000-0001-5523-7388","observed_orcids":["https://orcid.org/0000-0001-5523-7388"]},"institutions":[{"id":"https://openalex.org/I142606810","display_name":"Pacific Northwest National Laboratory","ror":"https://ror.org/05h992307","country_code":"US","type":"facility","lineage":["https://openalex.org/I1325736334","https://openalex.org/I1330989302","https://openalex.org/I142606810","https://openalex.org/I39565521"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Maciej Gutowski","raw_affiliation_strings":["Pacific Northwest National Laboratory"],"raw_orcid":"https://orcid.org/0000-0001-5523-7388","affiliations":[{"raw_affiliation_string":"Pacific Northwest National Laboratory","institution_ids":["https://openalex.org/I142606810"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.0,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":null,"issue":null,"first_page":null,"last_page":null},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10523","display_name":"Atomic and Molecular Physics","score":0.8877000212669373,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10523","display_name":"Atomic and Molecular Physics","score":0.8877000212669373,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11129","display_name":"Photochemistry and Electron Transfer Studies","score":0.02850000001490116,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical 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/T10432","display_name":"DNA and Nucleic Acid Chemistry","score":0.017899999395012856,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/deprotonation-energy","display_name":"deprotonation energy","score":0.875},{"id":"https://openalex.org/keywords/protonation-energy","display_name":"protonation energy","score":0.843999981880188},{"id":"https://openalex.org/keywords/low-energy-electrons","display_name":"low-energy electrons","score":0.6340000033378601},{"id":"https://openalex.org/keywords/dna-damage","display_name":"DNA damage","score":0.9440000057220459},{"id":"https://openalex.org/keywords/phenol-isomers","display_name":"phenol isomers","score":0.5509999990463257},{"id":"https://openalex.org/keywords/alanine","display_name":"alanine","score":0.3499999940395355},{"id":"https://openalex.org/keywords/formic-acid","display_name":"formic acid","score":0.875},{"id":"https://openalex.org/keywords/hydrogen-selenide","display_name":"hydrogen selenide","score":0.765999972820282},{"id":"https://openalex.org/keywords/hydrogen-sulfide","display_name":"hydrogen sulfide","score":0.9980000257492065}],"concepts":[{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.9051119089126587},{"id":"https://openalex.org/C118629725","wikidata":"https://www.wikidata.org/wiki/Q2686738","display_name":"Deprotonation","level":3,"score":0.8985376358032227},{"id":"https://openalex.org/C2779554091","wikidata":"https://www.wikidata.org/wiki/Q182990","display_name":"Uracil","level":3,"score":0.8001090884208679},{"id":"https://openalex.org/C30095370","wikidata":"https://www.wikidata.org/wiki/Q899488","display_name":"Protonation","level":3,"score":0.7116078734397888},{"id":"https://openalex.org/C54516573","wikidata":"https://www.wikidata.org/wiki/Q2294","display_name":"Proton","level":2,"score":0.5715059638023376},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.5020089149475098},{"id":"https://openalex.org/C75473681","wikidata":"https://www.wikidata.org/wiki/Q188651","display_name":"Photochemistry","level":1,"score":0.47657155990600586},{"id":"https://openalex.org/C110010208","wikidata":"https://www.wikidata.org/wiki/Q7252048","display_name":"Proton-coupled electron transfer","level":3,"score":0.43186965584754944},{"id":"https://openalex.org/C123669783","wikidata":"https://www.wikidata.org/wiki/Q902898","display_name":"Electron transfer","level":2,"score":0.37085556983947754},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.36014506220817566},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.21327412128448486},{"id":"https://openalex.org/C145148216","wikidata":"https://www.wikidata.org/wiki/Q36496","display_name":"Ion","level":2,"score":0.12485244870185852},{"id":"https://openalex.org/C552990157","wikidata":"https://www.wikidata.org/wiki/Q7430","display_name":"DNA","level":2,"score":0.09457576274871826},{"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/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.0},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.0}],"mesh":[],"locations_count":2,"locations":[{"id":"pmh:oai:CiteSeerX.psu:10.1.1.625.9169","doi":null,"is_oa":false,"landing_page_url":"http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.625.9169","pdf_url":null,"source":null,"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"http://biochempress.com/Files/IECMD_2003/IECMD_2003_011.pdf","raw_type":"text"},{"id":"mag:336327293","doi":null,"is_oa":false,"landing_page_url":"http://biochempress.com/Files/IECMD_2003/IECMD_2003_011.pdf","pdf_url":null,"source":null,"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":36,"referenced_works":["https://openalex.org/W285749399","https://openalex.org/W1967482965","https://openalex.org/W1969639951","https://openalex.org/W1978102463","https://openalex.org/W1979850841","https://openalex.org/W1980653332","https://openalex.org/W1981451973","https://openalex.org/W1988396655","https://openalex.org/W1993091782","https://openalex.org/W1993120988","https://openalex.org/W1999346017","https://openalex.org/W2006098916","https://openalex.org/W2006476025","https://openalex.org/W2008086050","https://openalex.org/W2009637194","https://openalex.org/W2010790627","https://openalex.org/W2015449203","https://openalex.org/W2023271753","https://openalex.org/W2026456627","https://openalex.org/W2033051992","https://openalex.org/W2033203918","https://openalex.org/W2034663299","https://openalex.org/W2041894527","https://openalex.org/W2044594452","https://openalex.org/W2046412723","https://openalex.org/W2058363175","https://openalex.org/W2062978955","https://openalex.org/W2064555280","https://openalex.org/W2086957099","https://openalex.org/W2091337681","https://openalex.org/W2095491033","https://openalex.org/W2101608919","https://openalex.org/W2143981217","https://openalex.org/W2230728100","https://openalex.org/W2342556788","https://openalex.org/W2949203728"],"related_works":["https://openalex.org/W1969639951","https://openalex.org/W2062978955","https://openalex.org/W1988396655","https://openalex.org/W2006476025","https://openalex.org/W2030346178","https://openalex.org/W1976956325","https://openalex.org/W1977730472","https://openalex.org/W2020656800","https://openalex.org/W1966697093","https://openalex.org/W2037325361"],"abstract_inverted_index":{"Motivation.":[0],"The":[1,16,57,155,166,181],"experiments":[2],"suggest":[3,23],"that":[4,24,81,122],"low-energy":[5],"electrons,":[6],"possibly":[7],"localized":[8,70],"on":[9,71,223],"nucleic":[10,34,113],"acid":[11,35,40,51,114],"bases,":[12],"induce":[13,42],"DNA":[14],"damage.":[15],"results":[17],"of":[18,32,55,87,106,125,134,141,149,152,183,196,208,226],"our":[19,163],"recent":[20],"studies":[21,78],"strongly":[22],"the":[25,30,49,53,61,67,104,123,128,135,138,146,150,194,224],"excess":[26,68],"electron":[27,69],"attachment":[28],"to":[29,52,65,201,236],"complex":[31],"a":[33,43,72,142,234],"base":[36],"with":[37,89,172,187],"an":[38,132],"amino":[39,50],"can":[41,230],"barrier-free":[44],"proton":[45,62,107,118,143],"transfer":[46,63,108],"(BFPT)":[47],"from":[48,198],"O8":[54],"uracil.":[56,153],"driving":[58],"force":[59],"for":[60],"is":[64,131],"stabilize":[66],"\u03c0":[73],"*":[74,174],"orbital.":[75],"Our":[76],"further":[77],"also":[79],"demonstrated":[80],"BFPT":[82,126],"occurs":[83],"in":[84,109,127,190,215],"anionic":[85,112],"complexes":[86,110,130],"uracil":[88,129],"alanine,":[90],"formic":[91],"acid,":[92],"as":[93,95,162,233],"well":[94],"H2Se":[96],"and":[97,117,145,168,212,229],"H2S.":[98],"We":[99,120],"briefly":[100],"determined":[101],"factors":[102],"governing":[103],"occurrence":[105,124],"between":[111,137],"bases":[115],"(NABs)":[116],"donors.":[119],"found":[121],"outcome":[133],"interplay":[136],"deprotonation":[139,197,227],"energy":[140,148,195,228],"donor":[144],"protonation":[147],"anion":[151],"Method.":[154],"density":[156],"functional":[157],"theory":[158],"(DFT)":[159],"was":[160],"applied":[161],"research":[164],"method.":[165],"B3LYP":[167],"MPW1K":[169],"exchange-correlation":[170],"functionals":[171],"6-31++G*":[173],"(5d)":[175],"basis":[176],"set":[177],"were":[178],"used.":[179],"Results.":[180],"substitution":[182],"five":[184],"hydrogen":[185],"atoms":[186,189],"fluorine":[188],"phenol":[191,210],"molecule":[192],"decreases":[193],"15.3":[199],"eV":[200],"14.4":[202],"eV.":[203],"There":[204],"are":[205],"5":[206],"groups":[207],"F-substituted":[209],"isomers":[211],"19":[213,218],"structures":[214],"total.":[216],"These":[217],"molecules":[219],"provide":[220],"fine":[221],"grid":[222],"scale":[225],"be":[231],"used":[232],"probe":[235]},"counts_by_year":[],"updated_date":"2026-11-08T12:12:28.789561","created_date":"2016-06-24T00:00:00"}
