{"id":"https://openalex.org/W1967698682","doi":"https://doi.org/10.1002/chir.10287","title":"Absolute configuration determination of chiral molecules in the solution state using vibrational circular dichroism","display_name":"Absolute configuration determination of chiral molecules in the solution state using vibrational circular dichroism","publication_year":2003,"publication_date":"2003-01-01","ids":{"openalex":"https://openalex.org/W1967698682","doi":"https://doi.org/10.1002/chir.10287","mag":"1967698682","pmid":"https://pubmed.ncbi.nlm.nih.gov/14556210"},"language":"en","primary_location":{"id":"doi:10.1002/chir.10287","doi":"https://doi.org/10.1002/chir.10287","is_oa":false,"landing_page_url":"https://doi.org/10.1002/chir.10287","pdf_url":null,"source":{"id":"https://openalex.org/S67976470","display_name":"Chirality","issn_l":"0899-0042","issn":["0899-0042","1520-636X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","medline","norway-1","poland-70","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Chirality","raw_type":"journal-article"},"volume":null,"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/A5040115708","display_name":"Teresa B. Freedman","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I70983195","display_name":"Syracuse University","ror":"https://ror.org/025r5qe02","country_code":"US","type":"education","lineage":["https://openalex.org/I70983195"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Teresa B. Freedman","raw_affiliation_strings":["Department of Chemistry, Syracuse University, Syracuse, New York 13244-4100, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Syracuse University, Syracuse, New York 13244-4100, USA","institution_ids":["https://openalex.org/I70983195"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5102025991","display_name":"Xiaolin Cao","orcid":"https://orcid.org/0000-0003-4039-9186","observed_orcids":["https://orcid.org/0000-0003-4039-9186"]},"institutions":[{"id":"https://openalex.org/I70983195","display_name":"Syracuse University","ror":"https://ror.org/025r5qe02","country_code":"US","type":"education","lineage":["https://openalex.org/I70983195"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Xiaolin Cao","raw_affiliation_strings":["Department of Chemistry, Syracuse University, Syracuse, New York"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Syracuse University, Syracuse, New York","institution_ids":["https://openalex.org/I70983195"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5039913165","display_name":"Rina K. Dukor","orcid":"https://orcid.org/0000-0002-1981-3381","observed_orcids":["https://orcid.org/0000-0002-1981-3381"]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Rina K. Dukor","raw_affiliation_strings":["BioTools, Inc., Wauconda, Illinois"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"BioTools, Inc., Wauconda, Illinois","institution_ids":[]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5048421851","display_name":"Laurence A. Nafi\u00e9","orcid":"https://orcid.org/0000-0002-3221-4332","observed_orcids":["https://orcid.org/0000-0002-3221-4332"]},"institutions":[{"id":"https://openalex.org/I70983195","display_name":"Syracuse University","ror":"https://ror.org/025r5qe02","country_code":"US","type":"education","lineage":["https://openalex.org/I70983195"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Laurence A. Nafie","raw_affiliation_strings":["Department of Chemistry, Syracuse University, Syracuse, New York"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Syracuse University, Syracuse, New York","institution_ids":["https://openalex.org/I70983195"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5048421851"],"corresponding_institution_ids":["https://openalex.org/I70983195"],"apc_list":{"value":4030,"currency":"USD","value_usd":4030},"apc_paid":null,"fwci":8.7504,"has_fulltext":false,"cited_by_count":525,"citation_normalized_percentile":{"value":0.98954605,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":99,"max":100},"biblio":{"volume":"15","issue":"9","first_page":"743","last_page":"758"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T12748","display_name":"Molecular spectroscopy and chirality","score":0.9994999766349792,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"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/T12748","display_name":"Molecular spectroscopy and chirality","score":0.9994999766349792,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"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/T10908","display_name":"Analytical Chemistry and Chromatography","score":9.999999747378752e-05,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"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/T12527","display_name":"Chemistry and Stereochemistry Studies","score":9.999999747378752e-05,"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/vibrational-circular-dichroism","display_name":"vibrational circular dichroism","score":0.9850000143051147},{"id":"https://openalex.org/keywords/absolute-configuration","display_name":"absolute configuration","score":0.9620000123977661},{"id":"https://openalex.org/keywords/chiral-molecules","display_name":"chiral molecules","score":0.9399999976158142},{"id":"https://openalex.org/keywords/solution-conformation","display_name":"solution conformation","score":0.8149999976158142},{"id":"https://openalex.org/keywords/conformational-analysis","display_name":"conformational analysis","score":0.8669999837875366},{"id":"https://openalex.org/keywords/chiroptical-methods","display_name":"chiroptical methods","score":0.7990000247955322}],"concepts":[{"id":"https://openalex.org/C25170562","wikidata":"https://www.wikidata.org/wiki/Q2052053","display_name":"Absolute configuration","level":2,"score":0.9287976026535034},{"id":"https://openalex.org/C189010761","wikidata":"https://www.wikidata.org/wiki/Q7924663","display_name":"Vibrational circular dichroism","level":3,"score":0.9217355251312256},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7939649820327759},{"id":"https://openalex.org/C133571119","wikidata":"https://www.wikidata.org/wiki/Q899102","display_name":"Circular dichroism","level":2,"score":0.6321996450424194},{"id":"https://openalex.org/C32909587","wikidata":"https://www.wikidata.org/wiki/Q11369","display_name":"Molecule","level":2,"score":0.5727460980415344},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.4164355397224426},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.25752538442611694},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.062386780977249146}],"mesh":[{"descriptor_ui":"D002942","descriptor_name":"Circular Dichroism","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":true},{"descriptor_ui":"D002942","descriptor_name":"Circular Dichroism","qualifier_ui":"Q000706","qualifier_name":"statistics & numerical data","is_major_topic":false},{"descriptor_ui":"D005583","descriptor_name":"Fourier Analysis","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008968","descriptor_name":"Molecular Conformation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D012996","descriptor_name":"Solutions","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013237","descriptor_name":"Stereoisomerism","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013816","descriptor_name":"Thermodynamics","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D017550","descriptor_name":"Spectroscopy, Fourier Transform Infrared","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1002/chir.10287","doi":"https://doi.org/10.1002/chir.10287","is_oa":false,"landing_page_url":"https://doi.org/10.1002/chir.10287","pdf_url":null,"source":{"id":"https://openalex.org/S67976470","display_name":"Chirality","issn_l":"0899-0042","issn":["0899-0042","1520-636X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-b","jufo-1","medline","norway-1","poland-70","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Chirality","raw_type":"journal-article"},{"id":"pmid:14556210","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/14556210","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":"Chirality","raw_type":"Journal Article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G151114530","display_name":"Near-Infrared VCD of Chiral Pharmaceuticals","funder_award_id":"5r01gm063148-03","funder_id":"https://openalex.org/F4320332161","funder_display_name":"National Institutes of Health"},{"id":"https://openalex.org/G631382284","display_name":null,"funder_award_id":"GM63148","funder_id":"https://openalex.org/F4320337354","funder_display_name":"National Institute of General Medical Sciences"}],"funders":[{"id":"https://openalex.org/F4320332161","display_name":"National Institutes of Health","ror":"https://ror.org/01cwqze88"},{"id":"https://openalex.org/F4320337354","display_name":"National Institute of General Medical Sciences","ror":"https://ror.org/04q48ey07"}],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":87,"referenced_works":["https://openalex.org/W612946456","https://openalex.org/W654970016","https://openalex.org/W1502872791","https://openalex.org/W1515020238","https://openalex.org/W1964685009","https://openalex.org/W1966503048","https://openalex.org/W1968853883","https://openalex.org/W1969778426","https://openalex.org/W1970347475","https://openalex.org/W1970992954","https://openalex.org/W1977840563","https://openalex.org/W1980135888","https://openalex.org/W1985739583","https://openalex.org/W1986253930","https://openalex.org/W1987998895","https://openalex.org/W1991034603","https://openalex.org/W1996641083","https://openalex.org/W1999042338","https://openalex.org/W1999305873","https://openalex.org/W2000129166","https://openalex.org/W2006869357","https://openalex.org/W2007312601","https://openalex.org/W2008725774","https://openalex.org/W2009212921","https://openalex.org/W2009914305","https://openalex.org/W2011290093","https://openalex.org/W2011851721","https://openalex.org/W2011931268","https://openalex.org/W2012306211","https://openalex.org/W2012962015","https://openalex.org/W2014526582","https://openalex.org/W2017333435","https://openalex.org/W2018144398","https://openalex.org/W2019389765","https://openalex.org/W2025169850","https://openalex.org/W2025901255","https://openalex.org/W2026981786","https://openalex.org/W2026991835","https://openalex.org/W2028843943","https://openalex.org/W2028859445","https://openalex.org/W2033004698","https://openalex.org/W2037538518","https://openalex.org/W2042802675","https://openalex.org/W2046486809","https://openalex.org/W2049345737","https://openalex.org/W2050201914","https://openalex.org/W2051408340","https://openalex.org/W2052648794","https://openalex.org/W2053275803","https://openalex.org/W2053949863","https://openalex.org/W2058045327","https://openalex.org/W2060272886","https://openalex.org/W2062096563","https://openalex.org/W2066289807","https://openalex.org/W2066345705","https://openalex.org/W2069876255","https://openalex.org/W2070058292","https://openalex.org/W2070223860","https://openalex.org/W2071033390","https://openalex.org/W2071746010","https://openalex.org/W2072698841","https://openalex.org/W2077863786","https://openalex.org/W2082789185","https://openalex.org/W2083804325","https://openalex.org/W2092745664","https://openalex.org/W2093588381","https://openalex.org/W2094912706","https://openalex.org/W2098773649","https://openalex.org/W2106341254","https://openalex.org/W2115773821","https://openalex.org/W2116611788","https://openalex.org/W2121455331","https://openalex.org/W2124380804","https://openalex.org/W2128874901","https://openalex.org/W2139746868","https://openalex.org/W2148284063","https://openalex.org/W2162586797","https://openalex.org/W2318426697","https://openalex.org/W2484620047","https://openalex.org/W2486711980","https://openalex.org/W2870580275","https://openalex.org/W2950492314","https://openalex.org/W2950531507","https://openalex.org/W3004972528","https://openalex.org/W3036251603","https://openalex.org/W4247461050","https://openalex.org/W7045094996"],"related_works":["https://openalex.org/W2952980254","https://openalex.org/W2042710292","https://openalex.org/W7062680293","https://openalex.org/W2319038042","https://openalex.org/W1968853883","https://openalex.org/W2950697344","https://openalex.org/W1539517978","https://openalex.org/W2008725774","https://openalex.org/W2994760913","https://openalex.org/W1984574756"],"abstract_inverted_index":{"Advances":[0],"in":[1,46,103],"the":[2,13,23,32,47,53,56,61,68,117],"measurement,":[3],"calculation,":[4],"and":[5,67,94,119],"application":[6],"of":[7,15,22,34,39,52,64,78,81,88,116,121,129],"vibrational":[8],"circular":[9],"dichroism":[10],"(VCD)":[11],"for":[12,42,60],"determination":[14],"absolute":[16,40,75,79],"configuration":[17,80],"are":[18,131],"described.":[19],"The":[20,50],"purpose":[21],"review":[24],"is":[25],"to":[26,36,72,124],"provide":[27],"an":[28,112],"up-to-date":[29],"perspective":[30],"on":[31],"capability":[33],"VCD":[35,65,85,96,122],"solve":[37],"problems":[38],"stereochemistry":[41],"chiral":[43],"molecules":[44],"primarily":[45],"solution":[48],"state.":[49],"scope":[51],"article":[54],"covers":[55],"experimental":[57],"methods":[58,128],"needed":[59],"accurate":[62],"measurement":[63],"spectra":[66],"theoretical":[69],"steps":[70],"required":[71],"systematically":[73],"deduce":[74],"configuration.":[76],"Determination":[77],"a":[82],"molecule":[83],"by":[84,107],"requires":[86],"knowledge":[87],"its":[89],"conformation":[90,101],"or":[91],"conformational":[92],"distribution,":[93],"hence":[95],"analysis":[97,130],"necessarily":[98],"provides":[99],"solution-state":[100],"information,":[102],"many":[104],"cases":[105],"available":[106,126],"no":[108],"other":[109,125],"method,":[110],"as":[111],"additional":[113],"benefit.":[114],"Comparisons":[115],"advantages":[118],"limitations":[120],"relative":[123],"chiroptical":[127],"also":[132],"presented.":[133]},"counts_by_year":[{"year":2026,"cited_by_count":20},{"year":2025,"cited_by_count":12},{"year":2024,"cited_by_count":11},{"year":2023,"cited_by_count":18},{"year":2022,"cited_by_count":16},{"year":2021,"cited_by_count":12},{"year":2020,"cited_by_count":16},{"year":2019,"cited_by_count":16},{"year":2018,"cited_by_count":28},{"year":2017,"cited_by_count":24},{"year":2016,"cited_by_count":18},{"year":2015,"cited_by_count":29},{"year":2014,"cited_by_count":35},{"year":2013,"cited_by_count":30},{"year":2012,"cited_by_count":27}],"updated_date":"2026-11-04T10:54:05.112534","created_date":"2016-06-24T00:00:00"}