{"id":"https://openalex.org/W2077321776","doi":"https://doi.org/10.1021/ci700296a","title":"Last Step of the Para Route of the Kolbe\u2212Schmitt Reaction","display_name":"Last Step of the Para Route of the Kolbe\u2212Schmitt Reaction","publication_year":2007,"publication_date":"2007-12-28","ids":{"openalex":"https://openalex.org/W2077321776","doi":"https://doi.org/10.1021/ci700296a","mag":"2077321776","pmid":"https://pubmed.ncbi.nlm.nih.gov/18161958"},"language":"en","primary_location":{"id":"doi:10.1021/ci700296a","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci700296a","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","pubmed"],"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/A5077823854","display_name":"Zoran Markovi\u0107","orcid":"https://orcid.org/0000-0001-5964-049X"},"institutions":[{"id":"https://openalex.org/I14245010","display_name":"University of Kragujevac","ror":"https://ror.org/04f7vj627","country_code":"RS","type":"education","lineage":["https://openalex.org/I14245010"]}],"countries":["RS"],"is_corresponding":false,"raw_author_name":"Zoran Markovi\u0107","raw_affiliation_strings":["Faculty of Agronomy, University of Kragujevac, 34 Cara Du\u0161ana, 32000 \u010ca\u010dak, Serbia, and Faculty of Science, University of Kragujevac, 12 Radoja Domanovi\u0107a, 34000 Kragujevac, Serbia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Faculty of Agronomy, University of Kragujevac, 34 Cara Du\u0161ana, 32000 \u010ca\u010dak, Serbia, and Faculty of Science, University of Kragujevac, 12 Radoja Domanovi\u0107a, 34000 Kragujevac, Serbia","institution_ids":["https://openalex.org/I14245010"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5045607547","display_name":"Svetlana Markovi\u0107","orcid":"https://orcid.org/0000-0003-3483-3599"},"institutions":[{"id":"https://openalex.org/I14245010","display_name":"University of Kragujevac","ror":"https://ror.org/04f7vj627","country_code":"RS","type":"education","lineage":["https://openalex.org/I14245010"]}],"countries":["RS"],"is_corresponding":false,"raw_author_name":"Svetlana Markovi\u0107","raw_affiliation_strings":["Faculty of Agronomy, University of Kragujevac, 34 Cara Du\u0161ana, 32000 \u010ca\u010dak, Serbia, and Faculty of Science, University of Kragujevac, 12 Radoja Domanovi\u0107a, 34000 Kragujevac, Serbia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Faculty of Agronomy, University of Kragujevac, 34 Cara Du\u0161ana, 32000 \u010ca\u010dak, Serbia, and Faculty of Science, University of Kragujevac, 12 Radoja Domanovi\u0107a, 34000 Kragujevac, Serbia","institution_ids":["https://openalex.org/I14245010"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":[],"corresponding_institution_ids":["https://openalex.org/I14245010"],"apc_list":null,"apc_paid":null,"fwci":1.796,"has_fulltext":false,"cited_by_count":10,"citation_normalized_percentile":{"value":0.85537201,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":94},"biblio":{"volume":"48","issue":"1","first_page":"143","last_page":"147"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10913","display_name":"Molecular Junctions and Nanostructures","score":0.9991999864578247,"subfield":{"id":"https://openalex.org/subfields/2208","display_name":"Electrical and Electronic Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10913","display_name":"Molecular Junctions and Nanostructures","score":0.9991999864578247,"subfield":{"id":"https://openalex.org/subfields/2208","display_name":"Electrical and Electronic Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11784","display_name":"CO2 Reduction Techniques and Catalysts","score":0.9991000294685364,"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/T10092","display_name":"Organometallic Complex Synthesis and Catalysis","score":0.998199999332428,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/carboxylation","display_name":"Carboxylation","score":0.772159218788147},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.6563560962677002},{"id":"https://openalex.org/keywords/radical","display_name":"Radical","score":0.4196426272392273},{"id":"https://openalex.org/keywords/computational-chemistry","display_name":"Computational chemistry","score":0.3315524756908417},{"id":"https://openalex.org/keywords/organic-chemistry","display_name":"Organic chemistry","score":0.2008775770664215},{"id":"https://openalex.org/keywords/catalysis","display_name":"Catalysis","score":0.1432250440120697}],"concepts":[{"id":"https://openalex.org/C24428623","wikidata":"https://www.wikidata.org/wiki/Q901081","display_name":"Carboxylation","level":3,"score":0.772159218788147},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.6563560962677002},{"id":"https://openalex.org/C139066938","wikidata":"https://www.wikidata.org/wiki/Q185056","display_name":"Radical","level":2,"score":0.4196426272392273},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.3315524756908417},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.2008775770664215},{"id":"https://openalex.org/C161790260","wikidata":"https://www.wikidata.org/wiki/Q82264","display_name":"Catalysis","level":2,"score":0.1432250440120697}],"mesh":[],"locations_count":2,"locations":[{"id":"doi:10.1021/ci700296a","is_oa":false,"landing_page_url":"https://doi.org/10.1021/ci700296a","pdf_url":null,"source":{"id":"https://openalex.org/S167262187","display_name":"Journal of Chemical Information and Modeling","issn_l":"1549-9596","issn":["1549-9596","1549-960X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310320006","host_organization_name":"American Chemical Society","host_organization_lineage":["https://openalex.org/P4310320006"],"host_organization_lineage_names":["American Chemical Society"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Chemical Information and Modeling","raw_type":"journal-article"},{"id":"pmid:18161958","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/18161958","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of chemical information and modeling","raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/7","display_name":"Affordable and clean energy","score":0.75}],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":20,"referenced_works":["https://openalex.org/W1966182479","https://openalex.org/W1984599229","https://openalex.org/W1985809679","https://openalex.org/W1987415821","https://openalex.org/W2008197497","https://openalex.org/W2015228571","https://openalex.org/W2023271753","https://openalex.org/W2024790059","https://openalex.org/W2032637751","https://openalex.org/W2044490585","https://openalex.org/W2050458211","https://openalex.org/W2068617439","https://openalex.org/W2083425966","https://openalex.org/W2086912373","https://openalex.org/W2086957099","https://openalex.org/W2094132978","https://openalex.org/W2143472868","https://openalex.org/W2143981217","https://openalex.org/W2176267204","https://openalex.org/W2181966401"],"related_works":["https://openalex.org/W4387497383","https://openalex.org/W2948807893","https://openalex.org/W2899084033","https://openalex.org/W2778153218","https://openalex.org/W2748952813","https://openalex.org/W1531601525","https://openalex.org/W2607424097","https://openalex.org/W2606230654","https://openalex.org/W2384464875","https://openalex.org/W2319480705"],"abstract_inverted_index":{"This":[0],"work":[1],"is":[2,28,66,96],"an":[3],"extension":[4],"of":[5,8,20,24,34,50,60,73],"our":[6],"investigations":[7],"the":[9,17,21,31,44,53,58,70,74,78,82,93],"Kolbe--Schmitt":[10,94],"reaction":[11,23,76,95,105],"mechanism.":[12],"The":[13,63],"last":[14,71],"step":[15,72],"in":[16,77,90],"para":[18],"route":[19],"carboxylation":[22,75],"alkali":[25],"metal":[26],"phenoxides":[27],"investigated":[29],"at":[30,98],"B3LYP/LANL2DZ":[32],"level":[33],"theory.":[35],"Among":[36],"several":[37],"examined":[38],"pathways,":[39],"two":[40],"mechanisms":[41],"are":[42,107],"proposed:":[43],"one":[45,55],"involving":[46],"a":[47],"successive":[48],"rearrangement":[49],"hydrogen":[51],"and":[52],"other":[54],"based":[56],"on":[57],"formation":[59],"free":[61],"radicals.":[62],"former":[64],"pathway":[65,84],"energetically":[67],"comparable":[68],"to":[69],"ortho":[79],"position,":[80],"whereas":[81],"latter":[83],"requires":[85],"higher":[86],"activation":[87],"energy.":[88],"Bearing":[89],"mind":[91],"that":[92,103],"performed":[97],"high":[99],"temperatures,":[100],"we":[101],"assume":[102],"both":[104],"paths":[106],"plausible.":[108]},"counts_by_year":[{"year":2024,"cited_by_count":1},{"year":2020,"cited_by_count":1},{"year":2016,"cited_by_count":1},{"year":2015,"cited_by_count":1},{"year":2012,"cited_by_count":1}],"updated_date":"2026-06-26T08:34:08.712188","created_date":"2025-10-10T00:00:00"}
