{"id":"https://openalex.org/W4407795649","doi":"https://doi.org/10.1016/j.molstruc.2025.141792","title":"Theoretical investigation, spectroscopic characterization, global chemical reactivity, nonlinear optical properties, and antioxidant activity of 2-(2,4-dimethoxybenzylidene)-hydrazono-1,2-diphenyl-ethanone","display_name":"Theoretical investigation, spectroscopic characterization, global chemical reactivity, nonlinear optical properties, and antioxidant activity of 2-(2,4-dimethoxybenzylidene)-hydrazono-1,2-diphenyl-ethanone","publication_year":2025,"publication_date":"2025-02-20","ids":{"openalex":"https://openalex.org/W4407795649","doi":"https://doi.org/10.1016/j.molstruc.2025.141792"},"language":"en","primary_location":{"id":"doi:10.1016/j.molstruc.2025.141792","doi":"https://doi.org/10.1016/j.molstruc.2025.141792","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.molstruc.2025.141792","pdf_url":null,"source":{"id":"https://openalex.org/S203479135","display_name":"Journal of Molecular Structure","issn_l":"0022-2860","issn":["0022-2860","1872-8014"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-d","jufo-1","ki-jl-1","norway-1","poland-70","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Molecular Structure","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"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/A5114655693","display_name":"Samia DJABBOUR","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I4210164694","display_name":"Hassiba Benbouali University of Chlef","ror":"https://ror.org/04yymzm67","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210164694"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"Samia DJABBOUR","raw_affiliation_strings":["Laboratory of Vegetal Chemistry, Water-Energy, Hassiba Benbouali University of Chlef, 02000, Chlef, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Vegetal Chemistry, Water-Energy, Hassiba Benbouali University of Chlef, 02000, Chlef, Algeria","institution_ids":["https://openalex.org/I4210164694"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5091531357","display_name":"Omar Besseboua","orcid":"https://orcid.org/0000-0003-1365-4479","observed_orcids":["https://orcid.org/0000-0003-1365-4479"]},"institutions":[{"id":"https://openalex.org/I4210124230","display_name":"Universit\u00e9 Mustapha Stambouli de Mascara","ror":"https://ror.org/02vqddp65","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210124230"]},{"id":"https://openalex.org/I4210164694","display_name":"Hassiba Benbouali University of Chlef","ror":"https://ror.org/04yymzm67","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210164694"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"Omar BESSEBOUA","raw_affiliation_strings":["Department of Agricultural Sciences, Faculty of Nature and Life Sciences, Univ. M. Stambouli, 29000, Mascara, Algeria","Department of Agronomic Sciences, Faculty of Life and Nature Sciences, University Hassiba Benbouali, 02000, Chlef, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Agricultural Sciences, Faculty of Nature and Life Sciences, Univ. M. Stambouli, 29000, Mascara, Algeria","institution_ids":["https://openalex.org/I4210124230"]},{"raw_affiliation_string":"Department of Agronomic Sciences, Faculty of Life and Nature Sciences, University Hassiba Benbouali, 02000, Chlef, Algeria","institution_ids":["https://openalex.org/I4210164694"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5055280926","display_name":"Abdelmadjid Benmohammed","orcid":"https://orcid.org/0009-0007-0350-8503","observed_orcids":["https://orcid.org/0009-0007-0350-8503"]},"institutions":[{"id":"https://openalex.org/I137407579","display_name":"Universit\u00e9 Oran 1 Ahmed Ben Bella","ror":"https://ror.org/059et2b68","country_code":"DZ","type":"education","lineage":["https://openalex.org/I137407579"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"Abdelmadjid BENMOHAMMED","raw_affiliation_strings":["Laboratory of Organic Applied Synthesis (LSOA), Department of Chemistry, Faculty of Sciences, University of Oran 1, Ahmed Ben Bella, 31000 Oran, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Organic Applied Synthesis (LSOA), Department of Chemistry, Faculty of Sciences, University of Oran 1, Ahmed Ben Bella, 31000 Oran, Algeria","institution_ids":["https://openalex.org/I137407579"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5043981078","display_name":"Nourdine Boukabcha","orcid":"https://orcid.org/0000-0002-9356-6323","observed_orcids":["https://orcid.org/0000-0002-9356-6323"]},"institutions":[{"id":"https://openalex.org/I177657909","display_name":"Universit\u00e9 de Mostaganem","ror":"https://ror.org/052r04325","country_code":"DZ","type":"education","lineage":["https://openalex.org/I177657909"]},{"id":"https://openalex.org/I4210164694","display_name":"Hassiba Benbouali University of Chlef","ror":"https://ror.org/04yymzm67","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210164694"]}],"countries":["DZ"],"is_corresponding":true,"raw_author_name":"Nourdine BOUKABCHA","raw_affiliation_strings":["Chemistry Department, Faculty of Exact Sciences and Informatic, Hassiba Benbouali University, Chlef 02000, Algeria","Laboratory of Technology and Solid Properties (LTPS), Faculty of Sciences and Technology, Abdelhamid Ibn Badis University of Mostaganem, Mostaganem 27000, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Chemistry Department, Faculty of Exact Sciences and Informatic, Hassiba Benbouali University, Chlef 02000, Algeria","institution_ids":["https://openalex.org/I4210164694"]},{"raw_affiliation_string":"Laboratory of Technology and Solid Properties (LTPS), Faculty of Sciences and Technology, Abdelhamid Ibn Badis University of Mostaganem, Mostaganem 27000, Algeria","institution_ids":["https://openalex.org/I177657909"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5039134142","display_name":"Meriem Goudjil","orcid":"https://orcid.org/0000-0003-3401-4294","observed_orcids":["https://orcid.org/0000-0003-3401-4294"]},"institutions":[{"id":"https://openalex.org/I45084792","display_name":"University of Florence","ror":"https://ror.org/04jr1s763","country_code":"IT","type":"education","lineage":["https://openalex.org/I45084792"]}],"countries":["IT"],"is_corresponding":false,"raw_author_name":"Meriem GOUDJIL","raw_affiliation_strings":["Department of Industrial Engineering, University of Florence, Via Santa Marta 3, Florence 50139, Italy"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Industrial Engineering, University of Florence, Via Santa Marta 3, Florence 50139, Italy","institution_ids":["https://openalex.org/I45084792"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5018567269","display_name":"Youcef Megrouss","orcid":"https://orcid.org/0000-0002-3823-6911","observed_orcids":["https://orcid.org/0000-0002-3823-6911"]},"institutions":[{"id":"https://openalex.org/I177657909","display_name":"Universit\u00e9 de Mostaganem","ror":"https://ror.org/052r04325","country_code":"DZ","type":"education","lineage":["https://openalex.org/I177657909"]},{"id":"https://openalex.org/I4210164694","display_name":"Hassiba Benbouali University of Chlef","ror":"https://ror.org/04yymzm67","country_code":"DZ","type":"education","lineage":["https://openalex.org/I4210164694"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"Youcef MEGROUSS","raw_affiliation_strings":["Chemistry Department, Faculty of Exact Sciences and Informatic, Hassiba Benbouali University, Chlef 02000, Algeria","Laboratory of Technology and Solid Properties (LTPS), Faculty of Sciences and Technology, Abdelhamid Ibn Badis University of Mostaganem, Mostaganem 27000, Algeria"],"raw_orcid":"https://orcid.org/0000-0002-3823-6911","affiliations":[{"raw_affiliation_string":"Chemistry Department, Faculty of Exact Sciences and Informatic, Hassiba Benbouali University, Chlef 02000, Algeria","institution_ids":["https://openalex.org/I4210164694"]},{"raw_affiliation_string":"Laboratory of Technology and Solid Properties (LTPS), Faculty of Sciences and Technology, Abdelhamid Ibn Badis University of Mostaganem, Mostaganem 27000, Algeria","institution_ids":["https://openalex.org/I177657909"]}]},{"author_position":"middle","author":{"id":null,"display_name":"Mohammad Shahidul Islam","orcid":"https://orcid.org/0000-0002-4612-5875","observed_orcids":["https://orcid.org/0000-0002-4612-5875"]},"institutions":[{"id":"https://openalex.org/I28022161","display_name":"King Saud University","ror":"https://ror.org/02f81g417","country_code":"SA","type":"education","lineage":["https://openalex.org/I28022161"]}],"countries":["SA"],"is_corresponding":false,"raw_author_name":"Mohammad Shahidul Islam","raw_affiliation_strings":["department of Chemistry, College of Science, king Saud university, P.O.Box 2455, Riyadh 11451, Saudi Arabia"],"raw_orcid":"https://orcid.org/0000-0002-4612-5875","affiliations":[{"raw_affiliation_string":"department of Chemistry, College of Science, king Saud university, P.O.Box 2455, Riyadh 11451, Saudi Arabia","institution_ids":["https://openalex.org/I28022161"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5087198736","display_name":"Abdelkader Choua\u0131h","orcid":"https://orcid.org/0000-0002-3769-358X","observed_orcids":["https://orcid.org/0000-0002-3769-358X"]},"institutions":[{"id":"https://openalex.org/I177657909","display_name":"Universit\u00e9 de Mostaganem","ror":"https://ror.org/052r04325","country_code":"DZ","type":"education","lineage":["https://openalex.org/I177657909"]}],"countries":["DZ"],"is_corresponding":false,"raw_author_name":"Abdelkader CHOUAIH","raw_affiliation_strings":["Laboratory of Technology and Solid Properties (LTPS), Faculty of Sciences and Technology, Abdelhamid Ibn Badis University of Mostaganem, Mostaganem 27000, Algeria"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Technology and Solid Properties (LTPS), Faculty of Sciences and Technology, Abdelhamid Ibn Badis University of Mostaganem, Mostaganem 27000, Algeria","institution_ids":["https://openalex.org/I177657909"]}]}],"institutions":[],"countries_distinct_count":3,"institutions_distinct_count":6,"corresponding_author_ids":["https://openalex.org/A5043981078"],"corresponding_institution_ids":["https://openalex.org/I177657909","https://openalex.org/I4210164694"],"apc_list":{"value":3360,"currency":"USD","value_usd":3360},"apc_paid":null,"fwci":1.563,"has_fulltext":false,"cited_by_count":10,"citation_normalized_percentile":{"value":0.81585282,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":97,"max":99},"biblio":{"volume":"1334","issue":null,"first_page":"141792","last_page":"141792"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11025","display_name":"Nonlinear Optical Materials Research","score":0.9994999766349792,"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"}},"topics":[{"id":"https://openalex.org/T11025","display_name":"Nonlinear Optical Materials Research","score":0.9994999766349792,"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"}},{"id":"https://openalex.org/T11177","display_name":"Spectroscopy and Quantum Chemical Studies","score":9.999999747378752e-05,"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/T10002","display_name":"Advanced Chemical Physics Studies","score":0.0,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/vibrational-assignment","display_name":"vibrational assignment","score":0.6539999842643738},{"id":"https://openalex.org/keywords/frontier-molecular-orbitals","display_name":"frontier molecular orbitals","score":0.871999979019165},{"id":"https://openalex.org/keywords/homo-lumo-gap","display_name":"HOMO-LUMO gap","score":0.9779999852180481},{"id":"https://openalex.org/keywords/intramolecular-charge-transfer","display_name":"intramolecular charge transfer","score":0.9700000286102295},{"id":"https://openalex.org/keywords/nonlinear-optical-properties","display_name":"nonlinear optical properties","score":0.7829999923706055},{"id":"https://openalex.org/keywords/hyperpolarizability","display_name":"hyperpolarizability","score":0.9150000214576721},{"id":"https://openalex.org/keywords/molecular-electrostatic-potential","display_name":"molecular electrostatic potential","score":0.8450000286102295},{"id":"https://openalex.org/keywords/antioxidant-activity","display_name":"antioxidant activity","score":0.9610000252723694},{"id":"https://openalex.org/keywords/dpph-radical-scavenging-activity","display_name":"DPPH radical scavenging","score":0.9520000219345093},{"id":"https://openalex.org/keywords/reactivity-descriptors","display_name":"reactivity descriptors","score":0.800000011920929}],"concepts":[{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.9864691495895386},{"id":"https://openalex.org/C2780841128","wikidata":"https://www.wikidata.org/wiki/Q5073781","display_name":"Characterization (materials science)","level":2,"score":0.7435744404792786},{"id":"https://openalex.org/C2776910235","wikidata":"https://www.wikidata.org/wiki/Q18574","display_name":"Reactivity (psychology)","level":3,"score":0.577771782875061},{"id":"https://openalex.org/C2778004101","wikidata":"https://www.wikidata.org/wiki/Q133948","display_name":"Antioxidant","level":2,"score":0.57136070728302},{"id":"https://openalex.org/C2991936344","wikidata":"https://www.wikidata.org/wiki/Q756033","display_name":"Nonlinear optical","level":3,"score":0.4614182412624359},{"id":"https://openalex.org/C147789679","wikidata":"https://www.wikidata.org/wiki/Q11372","display_name":"Physical chemistry","level":1,"score":0.4137829542160034},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.391736775636673},{"id":"https://openalex.org/C158622935","wikidata":"https://www.wikidata.org/wiki/Q660848","display_name":"Nonlinear system","level":2,"score":0.31496548652648926},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.2931826710700989},{"id":"https://openalex.org/C171250308","wikidata":"https://www.wikidata.org/wiki/Q11468","display_name":"Nanotechnology","level":1,"score":0.213534414768219},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.0},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"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/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","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/C142724271","wikidata":"https://www.wikidata.org/wiki/Q7208","display_name":"Pathology","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1016/j.molstruc.2025.141792","doi":"https://doi.org/10.1016/j.molstruc.2025.141792","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.molstruc.2025.141792","pdf_url":null,"source":{"id":"https://openalex.org/S203479135","display_name":"Journal of Molecular Structure","issn_l":"0022-2860","issn":["0022-2860","1872-8014"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-d","jufo-1","ki-jl-1","norway-1","poland-70","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Molecular Structure","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G5291367207","display_name":null,"funder_award_id":"B00L01UN020120230006","funder_id":"https://openalex.org/F4320326612","funder_display_name":"Universit\u00e9 Hassiba Benbouali de Chlef"},{"id":"https://openalex.org/G5584223101","display_name":null,"funder_award_id":"RSPD2025R1100","funder_id":"https://openalex.org/F4320326612","funder_display_name":"Universit\u00e9 Hassiba Benbouali de Chlef"}],"funders":[{"id":"https://openalex.org/F4320321145","display_name":"King Saud University","ror":"https://ror.org/02f81g417"},{"id":"https://openalex.org/F4320321424","display_name":"Minist\u00e8re de l'Enseignement Sup\u00e9rieur et de la Recherche Scientifique","ror":"https://ror.org/01ejfgc23"},{"id":"https://openalex.org/F4320326612","display_name":"Universit\u00e9 Hassiba Benbouali de Chlef","ror":"https://ror.org/04yymzm67"},{"id":"https://openalex.org/F4320335007","display_name":"Direction G\u00e9n\u00e9rale de la Recherche Scientifique et du D\u00e9veloppement Technologique","ror":"https://ror.org/04jpfrv51"}],"has_content":{"pdf":false,"grobid_xml":false},"content_urls":null,"referenced_works_count":76,"referenced_works":["https://openalex.org/W575866517","https://openalex.org/W1232346436","https://openalex.org/W1560694348","https://openalex.org/W1971874780","https://openalex.org/W1978417641","https://openalex.org/W1985010001","https://openalex.org/W1985062061","https://openalex.org/W1987687136","https://openalex.org/W1988667083","https://openalex.org/W1988873613","https://openalex.org/W2007633892","https://openalex.org/W2009458392","https://openalex.org/W2010214115","https://openalex.org/W2012834695","https://openalex.org/W2016841413","https://openalex.org/W2035019555","https://openalex.org/W2036708333","https://openalex.org/W2040530197","https://openalex.org/W2042563735","https://openalex.org/W2043973818","https://openalex.org/W2044910245","https://openalex.org/W2046001773","https://openalex.org/W2046149340","https://openalex.org/W2049108311","https://openalex.org/W2052273714","https://openalex.org/W2054164390","https://openalex.org/W2071009685","https://openalex.org/W2081585157","https://openalex.org/W2085837863","https://openalex.org/W2088702507","https://openalex.org/W2092964490","https://openalex.org/W2106824077","https://openalex.org/W2109492863","https://openalex.org/W2111773486","https://openalex.org/W2163720896","https://openalex.org/W2171657603","https://openalex.org/W2171839397","https://openalex.org/W2198570186","https://openalex.org/W2218233515","https://openalex.org/W2219748775","https://openalex.org/W2261992211","https://openalex.org/W2335124900","https://openalex.org/W2335330263","https://openalex.org/W2341871061","https://openalex.org/W2347828878","https://openalex.org/W2402855414","https://openalex.org/W2404296394","https://openalex.org/W2469169778","https://openalex.org/W2587835631","https://openalex.org/W2598092004","https://openalex.org/W2604956182","https://openalex.org/W2605254180","https://openalex.org/W2606404372","https://openalex.org/W2607256179","https://openalex.org/W2767628630","https://openalex.org/W2904871115","https://openalex.org/W2926035017","https://openalex.org/W2936676283","https://openalex.org/W2946064188","https://openalex.org/W3045349677","https://openalex.org/W3047270069","https://openalex.org/W3158756318","https://openalex.org/W3199981457","https://openalex.org/W4231649355","https://openalex.org/W4232135728","https://openalex.org/W4246248284","https://openalex.org/W4246538139","https://openalex.org/W4301912679","https://openalex.org/W4306168806","https://openalex.org/W4306835785","https://openalex.org/W4366503424","https://openalex.org/W4379468461","https://openalex.org/W4386888618","https://openalex.org/W4397030411","https://openalex.org/W4404396695","https://openalex.org/W6728455457"],"related_works":["https://openalex.org/W4309077429","https://openalex.org/W7152093019","https://openalex.org/W4386826138","https://openalex.org/W4391150858","https://openalex.org/W7162627518","https://openalex.org/W4406080783","https://openalex.org/W2076965499","https://openalex.org/W2947766942","https://openalex.org/W4214945982","https://openalex.org/W4414741167"],"abstract_inverted_index":null,"counts_by_year":[{"year":2026,"cited_by_count":6},{"year":2025,"cited_by_count":4}],"updated_date":"2026-10-16T09:59:22.235173","created_date":"2025-02-21T00:00:00"}