{"id":"https://openalex.org/W2007802592","doi":"https://doi.org/10.1107/s1600536812002450","title":"Ethyl 2-benzyl-3-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate","display_name":"Ethyl 2-benzyl-3-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate","publication_year":2012,"publication_date":"2012-01-27","ids":{"openalex":"https://openalex.org/W2007802592","doi":"https://doi.org/10.1107/s1600536812002450","mag":"2007802592","pmid":"https://pubmed.ncbi.nlm.nih.gov/22347143","pmcid":"https://www.ncbi.nlm.nih.gov/pmc/articles/3275287"},"language":"en","primary_location":{"id":"doi:10.1107/s1600536812002450","doi":"https://doi.org/10.1107/s1600536812002450","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s1600536812002450","pdf_url":null,"source":{"id":"https://openalex.org/S146636433","display_name":"Acta Crystallographica Section E Structure Reports Online","issn_l":"1600-5368","issn":["1600-5368"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj"],"host_organization":"https://openalex.org/P4310320555","host_organization_name":"International Union of Crystallography","host_organization_lineage":["https://openalex.org/P4310320555"],"host_organization_lineage_names":["International Union of Crystallography"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallographica Section E Structure Reports Online","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","doaj","pubmed"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://doi.org/10.1107/s1600536812002450","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":null,"display_name":"P. Kamatchi","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I860813019","display_name":"Bharath University","ror":"https://ror.org/04yazpn06","country_code":"IN","type":"education","lineage":["https://openalex.org/I860813019"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"P. Kamatchi","raw_affiliation_strings":["Department of Chemistry, Bharathi Women's College, Chennai 600 108, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Bharathi Women's College, Chennai 600 108, India","institution_ids":["https://openalex.org/I860813019"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5112104300","display_name":"G. Jagadeesan","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I4405281587","display_name":"Presidency College","ror":"https://ror.org/04kfbh280","country_code":"IN","type":"education","lineage":["https://openalex.org/I4405281587"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"G. Jagadeesan","raw_affiliation_strings":["Department of Physics, Presidency College, Chennai 600 005, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Physics, Presidency College, Chennai 600 005, India","institution_ids":["https://openalex.org/I4405281587"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5049765513","display_name":"M. Pramesh","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I112576028","display_name":"Central Leather Research Institute","ror":"https://ror.org/02kp7p620","country_code":"IN","type":"facility","lineage":["https://openalex.org/I112576028","https://openalex.org/I2799351866","https://openalex.org/I4210134808","https://openalex.org/I66760702"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"M. Pramesh","raw_affiliation_strings":["Organic Chemistry Laboratory, CLRI, Chennai 600 020, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Organic Chemistry Laboratory, CLRI, Chennai 600 020, India","institution_ids":["https://openalex.org/I112576028"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5054216491","display_name":"Paramasivan Thirumalai Perumal","orcid":"https://orcid.org/0000-0003-2057-6368","observed_orcids":["https://orcid.org/0000-0003-2057-6368"]},"institutions":[{"id":"https://openalex.org/I112576028","display_name":"Central Leather Research Institute","ror":"https://ror.org/02kp7p620","country_code":"IN","type":"facility","lineage":["https://openalex.org/I112576028","https://openalex.org/I2799351866","https://openalex.org/I4210134808","https://openalex.org/I66760702"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"P. T. Perumal","raw_affiliation_strings":["Organic Chemistry Laboratory, CLRI, Chennai 600 020, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Organic Chemistry Laboratory, CLRI, Chennai 600 020, India","institution_ids":["https://openalex.org/I112576028"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5088448569","display_name":"S. Aravindhan","orcid":"https://orcid.org/0000-0002-7643-9912","observed_orcids":["https://orcid.org/0000-0002-7643-9912"]},"institutions":[{"id":"https://openalex.org/I4405281587","display_name":"Presidency College","ror":"https://ror.org/04kfbh280","country_code":"IN","type":"education","lineage":["https://openalex.org/I4405281587"]}],"countries":["IN"],"is_corresponding":true,"raw_author_name":"S. Aravindhan","raw_affiliation_strings":["Department of Physics, Presidency College, Chennai 600 005, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Physics, Presidency College, Chennai 600 005, India","institution_ids":["https://openalex.org/I4405281587"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5088448569"],"corresponding_institution_ids":["https://openalex.org/I4405281587"],"apc_list":{"value":500,"currency":"USD","value_usd":500},"apc_paid":{"value":500,"currency":"USD","value_usd":500},"fwci":0.1507,"has_fulltext":true,"cited_by_count":2,"citation_normalized_percentile":{"value":0.41351989,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":88,"max":93},"biblio":{"volume":"68","issue":"2","first_page":"o552","last_page":"o552"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10464","display_name":"Crystal structures of chemical compounds","score":0.9980000257492065,"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/T10464","display_name":"Crystal structures of chemical compounds","score":0.9980000257492065,"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/T10798","display_name":"Crystallography and molecular interactions","score":0.00039999998989515007,"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/T12410","display_name":"Structural and Chemical Analysis of Organic and Inorganic Compounds","score":0.00039999998989515007,"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/pyrazoles","display_name":"pyrazole derivatives","score":0.6859999895095825},{"id":"https://openalex.org/keywords/fused-heterocycles","display_name":"fused heterocycles","score":0.5220000147819519},{"id":"https://openalex.org/keywords/half-chair-conformation","display_name":"half-chair conformation","score":0.8360000252723694},{"id":"https://openalex.org/keywords/inversion-dimers","display_name":"inversion dimers","score":0.8100000023841858},{"id":"https://openalex.org/keywords/c-hcl-interactions","display_name":"C-H\u22efCl interactions","score":0.8500000238418579},{"id":"https://openalex.org/keywords/c-ho-hydrogen-bonds","display_name":"C-H\u22efO hydrogen bonds","score":0.9670000076293945},{"id":"https://openalex.org/keywords/c-hpi-interactions","display_name":"C-H\u22ef\u03c0 interactions","score":0.9860000014305115},{"id":"https://openalex.org/keywords/molecular-conformation","display_name":"molecular conformation","score":0.546999990940094}],"concepts":[{"id":"https://openalex.org/C2779400197","wikidata":"https://www.wikidata.org/wiki/Q242627","display_name":"Pyrrole","level":2,"score":0.7883763909339905},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7243581414222717},{"id":"https://openalex.org/C2780378348","wikidata":"https://www.wikidata.org/wiki/Q25351438","display_name":"Ring (chemistry)","level":2,"score":0.6430163383483887},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.5072607398033142},{"id":"https://openalex.org/C2778074193","wikidata":"https://www.wikidata.org/wiki/Q3498942","display_name":"Carboxylate","level":2,"score":0.45771661400794983},{"id":"https://openalex.org/C115624301","wikidata":"https://www.wikidata.org/wiki/Q895901","display_name":"Crystal structure","level":2,"score":0.4406573176383972},{"id":"https://openalex.org/C2781285689","wikidata":"https://www.wikidata.org/wiki/Q21921428","display_name":"Crystal (programming language)","level":2,"score":0.4354532063007355},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.4156005084514618},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.03942298889160156},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.03859338164329529},{"id":"https://openalex.org/C199360897","wikidata":"https://www.wikidata.org/wiki/Q9143","display_name":"Programming language","level":1,"score":0.0}],"mesh":[],"locations_count":4,"locations":[{"id":"doi:10.1107/s1600536812002450","doi":"https://doi.org/10.1107/s1600536812002450","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s1600536812002450","pdf_url":null,"source":{"id":"https://openalex.org/S146636433","display_name":"Acta Crystallographica Section E Structure Reports Online","issn_l":"1600-5368","issn":["1600-5368"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj"],"host_organization":"https://openalex.org/P4310320555","host_organization_name":"International Union of Crystallography","host_organization_lineage":["https://openalex.org/P4310320555"],"host_organization_lineage_names":["International Union of Crystallography"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallographica Section E Structure Reports Online","raw_type":"journal-article"},{"id":"pmh:oai:pubmedcentral.nih.gov:3275287","doi":null,"is_oa":true,"landing_page_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC3275287/","pdf_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC3275287/pdf/","source":{"id":"https://openalex.org/S2764455111","display_name":"PubMed Central","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"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":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallogr Sect E Struct Rep Online","raw_type":"Text"},{"id":"pmid:22347143","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/22347143","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,"listed_in":[],"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":"Acta crystallographica. Section E, Structure reports online","raw_type":"Journal Article"},{"id":"pmh:oai:doaj.org/article:a2142e5f3b6543548cc4580916f69c7a","doi":null,"is_oa":true,"landing_page_url":"https://doaj.org/article/a2142e5f3b6543548cc4580916f69c7a","pdf_url":null,"source":{"id":"https://openalex.org/S4306401280","display_name":"DOAJ (DOAJ: Directory of Open Access Journals)","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":"cc-by-sa","license_id":"https://openalex.org/licenses/cc-by-sa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Acta Crystallographica Section E, Vol 68, Iss 2, Pp o552-o552 (2012)","raw_type":"article"}],"best_oa_location":{"id":"doi:10.1107/s1600536812002450","doi":"https://doi.org/10.1107/s1600536812002450","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s1600536812002450","pdf_url":null,"source":{"id":"https://openalex.org/S146636433","display_name":"Acta Crystallographica Section E Structure Reports Online","issn_l":"1600-5368","issn":["1600-5368"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj"],"host_organization":"https://openalex.org/P4310320555","host_organization_name":"International Union of Crystallography","host_organization_lineage":["https://openalex.org/P4310320555"],"host_organization_lineage_names":["International Union of Crystallography"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Acta Crystallographica Section E Structure Reports Online","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2007802592.pdf","grobid_xml":"https://content.openalex.org/works/W2007802592.grobid-xml"},"referenced_works_count":7,"referenced_works":["https://openalex.org/W1974178361","https://openalex.org/W1978582732","https://openalex.org/W2031158103","https://openalex.org/W2069051524","https://openalex.org/W2131350133","https://openalex.org/W2145538332","https://openalex.org/W2786774014"],"related_works":["https://openalex.org/W131043119","https://openalex.org/W2225929147","https://openalex.org/W4244245618","https://openalex.org/W1668876151","https://openalex.org/W2233943714","https://openalex.org/W2052048880","https://openalex.org/W1988928553","https://openalex.org/W1751070614","https://openalex.org/W296811363","https://openalex.org/W2240184120"],"abstract_inverted_index":{"The":[0,15],"title":[1],"compound,":[2],"C(37)H(31)ClN(4)O(4),":[3],"crystallizes":[4],"with":[5],"two":[6],"mol-ecules":[7,20,45,58],"(A":[8],"and":[9,33],"B)":[10],"in":[11,18,62],"the":[12,34,41,43,56,70],"asymmetric":[13],"unit.":[14],"pyrrole":[16],"rings":[17],"both":[19],"are":[21,73],"connected":[22],"via":[23,49,66],"cis":[24],"fusion,":[25],"whereas":[26],"one":[27],"ring":[28],"has":[29],"a":[30,37,50,75],"twisted":[31],"conformation":[32],"other":[35],"assumes":[36],"half-chair":[38],"conformation.":[39],"In":[40,69],"crystal,":[42,71],"A":[44],"form":[46,59],"inversion":[47],"dimers":[48],"pair":[51],"of":[52,77],"C-H\u22efCl":[53],"inter-actions,":[54],"while":[55],"B":[57],"chains":[60],"propagating":[61],"[1[Formula:":[63],"see":[64],"text]0],":[65],"C-H\u22efO":[67],"inter-actions.":[68],"there":[72],"also":[74],"number":[76],"C-H\u22ef\u03c0":[78],"inter-actions":[79],"present.":[80]},"counts_by_year":[{"year":2016,"cited_by_count":1},{"year":2013,"cited_by_count":1}],"updated_date":"2026-11-12T12:28:57.059296","created_date":"2016-06-24T00:00:00"}
