{"id":"https://openalex.org/W7223007904","doi":"https://doi.org/10.1107/s2056989026010406","title":"Crystal structure and Hirshfeld surface analysis of phenylalanine hydrobromide","display_name":"Crystal structure and Hirshfeld surface analysis of phenylalanine hydrobromide","publication_year":2026,"publication_date":"2026-10-20","ids":{"openalex":"https://openalex.org/W7223007904","doi":"https://doi.org/10.1107/s2056989026010406"},"language":"en","primary_location":{"id":"doi:10.1107/s2056989026010406","doi":"https://doi.org/10.1107/s2056989026010406","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s2056989026010406","pdf_url":"https://journals.iucr.org/e/issues/2026/11/00/nx2040/nx2040.pdf","source":{"id":"https://openalex.org/S2739106167","display_name":"Acta Crystallographica Section E Crystallographic Communications","issn_l":"2056-9890","issn":["2056-9890"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj","dongbi-c","jufo-1","norway-1","oarl","poland-20","russia-white-list-3"],"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 Crystallographic Communications","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","doaj"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://journals.iucr.org/e/issues/2026/11/00/nx2040/nx2040.pdf","any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5010710643","display_name":"Olesia I. Kucheriv","orcid":"https://orcid.org/0000-0002-3761-1150","observed_orcids":["https://orcid.org/0000-0002-3761-1150"]},"institutions":[{"id":"https://openalex.org/I189238007","display_name":"Taras Shevchenko National University of Kyiv","ror":"https://ror.org/02aaqv166","country_code":"UA","type":"education","lineage":["https://openalex.org/I189238007"]},{"id":"https://openalex.org/I19820366","display_name":"Chinese Academy of Sciences","ror":"https://ror.org/034t30j35","country_code":"CN","type":"government","lineage":["https://openalex.org/I19820366"]},{"id":"https://openalex.org/I4210155088","display_name":"Institute of Chemistry","ror":"https://ror.org/048y1rc66","country_code":"CN","type":"facility","lineage":["https://openalex.org/I19820366","https://openalex.org/I4210155088"]}],"countries":["CN","UA"],"is_corresponding":false,"raw_author_name":"Olesia I. Kucheriv","raw_affiliation_strings":["Department of Chemistry , Taras Shevchenko National University of Kyiv , Volodymyrska St. 64 , Kyiv 01601 , Ukraine,","Institute of Chemistry , Chinese Academy of Sciences"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry , Taras Shevchenko National University of Kyiv , Volodymyrska St. 64 , Kyiv 01601 , Ukraine,","institution_ids":["https://openalex.org/I189238007"]},{"raw_affiliation_string":"Institute of Chemistry , Chinese Academy of Sciences","institution_ids":["https://openalex.org/I19820366","https://openalex.org/I4210155088"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5067622811","display_name":"Alexandra Bargan","orcid":"https://orcid.org/0000-0002-9433-9595","observed_orcids":["https://orcid.org/0000-0002-9433-9595"]},"institutions":[{"id":"https://openalex.org/I4391767761","display_name":"Institutul de Chimie Macromolecular\u0103 Petru Poni","ror":"https://ror.org/0340mea86","country_code":"RO","type":"facility","lineage":["https://openalex.org/I4391767761","https://openalex.org/I58077936"]}],"countries":["RO"],"is_corresponding":false,"raw_author_name":"Alexandra Bargan","raw_affiliation_strings":["Department of Inorganic Polymers, Petru Poni Institute of Macromolecular Chemistry, Aleea Grigore Ghica Voda 41-A, Iasi 700487, Romania"],"raw_orcid":"https://orcid.org/0000-0002-9433-9595","affiliations":[{"raw_affiliation_string":"Department of Inorganic Polymers, Petru Poni Institute of Macromolecular Chemistry, Aleea Grigore Ghica Voda 41-A, Iasi 700487, Romania","institution_ids":["https://openalex.org/I4391767761"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5159038148","display_name":"Vadim Potaskalov","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I202483615","display_name":"National Technical University of Ukraine \u201cIgor Sikorsky Kyiv Polytechnic Institute\u201d","ror":"https://ror.org/00syn5v21","country_code":"UA","type":"education","lineage":["https://openalex.org/I202483615"]}],"countries":["UA"],"is_corresponding":false,"raw_author_name":"Vadim Potaskalov","raw_affiliation_strings":["Department of General and Inorganic Chemistry, National Technical University of Ukraine Igor Sikorsky Kyiv Polytechnic Institute, Beresteiskyi Pr. 37, Kyiv 03056, Ukraine"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of General and Inorganic Chemistry, National Technical University of Ukraine Igor Sikorsky Kyiv Polytechnic Institute, Beresteiskyi Pr. 37, Kyiv 03056, Ukraine","institution_ids":["https://openalex.org/I202483615"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5159129238","display_name":"Oleksii Brusylovets","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I189238007","display_name":"Taras Shevchenko National University of Kyiv","ror":"https://ror.org/02aaqv166","country_code":"UA","type":"education","lineage":["https://openalex.org/I189238007"]}],"countries":["UA"],"is_corresponding":false,"raw_author_name":"Oleksii Brusylovets","raw_affiliation_strings":["Department of Chemistry, Taras Shevchenko National University of Kyiv, Volodymyrska St. 64, Kyiv 01601, Ukraine"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Taras Shevchenko National University of Kyiv, Volodymyrska St. 64, Kyiv 01601, Ukraine","institution_ids":["https://openalex.org/I189238007"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5109654189","display_name":"\u041e\u043b\u0435\u043d\u0430 \u0412. \u041f\u0440\u0438\u0441\u044f\u0436\u043d\u0430","orcid":"https://orcid.org/0000-0002-4152-7891","observed_orcids":["https://orcid.org/0000-0002-4152-7891"]},"institutions":[{"id":"https://openalex.org/I149851306","display_name":"National Academy of Sciences of Ukraine","ror":"https://ror.org/00je4t102","country_code":"UA","type":"government","lineage":["https://openalex.org/I149851306"]},{"id":"https://openalex.org/I155165993","display_name":"Kyiv National University of Construction and Architecture","ror":"https://ror.org/02qp15436","country_code":"UA","type":"education","lineage":["https://openalex.org/I155165993"]},{"id":"https://openalex.org/I4210153810","display_name":"V. Bakul Institute for Superhard Materials","ror":"https://ror.org/04vq1gm90","country_code":"UA","type":"facility","lineage":["https://openalex.org/I149851306","https://openalex.org/I4210153810"]}],"countries":["UA"],"is_corresponding":false,"raw_author_name":"Olena Prysiazhna","raw_affiliation_strings":["Bakul Institute for Superhard Materials, National Academy of Sciences of Ukraine, Avtozavodska St. 2, Kyiv 04074, Ukraine","Institute of Innovative Education of Kyiv National University of Construction and Architecture, 4 Osvity Street, Kyiv 03037, Ukraine"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Bakul Institute for Superhard Materials, National Academy of Sciences of Ukraine, Avtozavodska St. 2, Kyiv 04074, Ukraine","institution_ids":["https://openalex.org/I149851306","https://openalex.org/I4210153810"]},{"raw_affiliation_string":"Institute of Innovative Education of Kyiv National University of Construction and Architecture, 4 Osvity Street, Kyiv 03037, Ukraine","institution_ids":["https://openalex.org/I155165993"]}]}],"institutions":[],"countries_distinct_count":3,"institutions_distinct_count":8,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":{"value":500,"currency":"USD","value_usd":500},"apc_paid":{"value":500,"currency":"USD","value_usd":500},"fwci":0.0,"has_fulltext":true,"cited_by_count":0,"citation_normalized_percentile":{"value":0.64319139,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"82","issue":"11","first_page":"1304","last_page":"1308"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10464","display_name":"Crystal structures of chemical compounds","score":0.9775000214576721,"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":0.9775000214576721,"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":0.021900000050663948,"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/T10939","display_name":"Crystal Structures and Properties","score":9.999999747378752e-05,"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"}}],"keywords":[{"id":"https://openalex.org/keywords/amino-acid-salts","display_name":"amino acid salts","score":0.9430000185966492},{"id":"https://openalex.org/keywords/crystal-structure","display_name":"crystal structure","score":0.8379999995231628},{"id":"https://openalex.org/keywords/hirshfeld-surface-analysis","display_name":"Hirshfeld surface analysis","score":0.953000009059906},{"id":"https://openalex.org/keywords/bromide","display_name":"bromide","score":0.9340000152587891},{"id":"https://openalex.org/keywords/c-hpi-interactions","display_name":"C-H\u22ef\u03c0 interactions","score":0.8220000267028809},{"id":"https://openalex.org/keywords/supramolecular-architecture","display_name":"supramolecular architecture","score":0.7950000166893005},{"id":"https://openalex.org/keywords/bilayer-packing","display_name":"bilayer packing","score":0.3869999945163727}],"concepts":[{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.9153000116348267},{"id":"https://openalex.org/C2779176119","wikidata":"https://www.wikidata.org/wiki/Q20974920","display_name":"Hydrobromide","level":2,"score":0.8162999749183655},{"id":"https://openalex.org/C112887158","wikidata":"https://www.wikidata.org/wiki/Q169324","display_name":"Hydrogen bond","level":3,"score":0.7649000287055969},{"id":"https://openalex.org/C115624301","wikidata":"https://www.wikidata.org/wiki/Q895901","display_name":"Crystal structure","level":2,"score":0.7648000121116638},{"id":"https://openalex.org/C37243968","wikidata":"https://www.wikidata.org/wiki/Q648961","display_name":"Orthorhombic crystal system","level":3,"score":0.7599999904632568},{"id":"https://openalex.org/C8010536","wikidata":"https://www.wikidata.org/wiki/Q160398","display_name":"Crystallography","level":1,"score":0.7279000282287598},{"id":"https://openalex.org/C30095370","wikidata":"https://www.wikidata.org/wiki/Q899488","display_name":"Protonation","level":3,"score":0.6966999769210815},{"id":"https://openalex.org/C93275456","wikidata":"https://www.wikidata.org/wiki/Q756449","display_name":"Supramolecular chemistry","level":3,"score":0.5867000222206116},{"id":"https://openalex.org/C2182769","wikidata":"https://www.wikidata.org/wiki/Q62500","display_name":"Ionic bonding","level":3,"score":0.4781000018119812},{"id":"https://openalex.org/C2776300020","wikidata":"https://www.wikidata.org/wiki/Q422423","display_name":"Bromide","level":2,"score":0.46230000257492065},{"id":"https://openalex.org/C100687433","wikidata":"https://www.wikidata.org/wiki/Q5139913","display_name":"Cocrystal","level":4,"score":0.43529999256134033},{"id":"https://openalex.org/C2777431362","wikidata":"https://www.wikidata.org/wiki/Q170545","display_name":"Phenylalanine","level":3,"score":0.4205999970436096},{"id":"https://openalex.org/C515207424","wikidata":"https://www.wikidata.org/wiki/Q8066","display_name":"Amino acid","level":2,"score":0.388700008392334},{"id":"https://openalex.org/C75079739","wikidata":"https://www.wikidata.org/wiki/Q1571801","display_name":"Intramolecular force","level":2,"score":0.3806000053882599},{"id":"https://openalex.org/C183882617","wikidata":"https://www.wikidata.org/wiki/Q3046749","display_name":"Cationic polymerization","level":2,"score":0.3693999946117401},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.36469998955726624},{"id":"https://openalex.org/C2781285689","wikidata":"https://www.wikidata.org/wiki/Q21921428","display_name":"Crystal (programming language)","level":2,"score":0.3434000015258789},{"id":"https://openalex.org/C29705727","wikidata":"https://www.wikidata.org/wiki/Q294562","display_name":"Polar","level":2,"score":0.3240000009536743},{"id":"https://openalex.org/C2781311116","wikidata":"https://www.wikidata.org/wiki/Q83306","display_name":"Group (periodic table)","level":2,"score":0.3179999887943268},{"id":"https://openalex.org/C5716244","wikidata":"https://www.wikidata.org/wiki/Q5191408","display_name":"Crystal engineering","level":4,"score":0.31189998984336853},{"id":"https://openalex.org/C46000676","wikidata":"https://www.wikidata.org/wiki/Q804644","display_name":"Lone pair","level":3,"score":0.30059999227523804},{"id":"https://openalex.org/C192406513","wikidata":"https://www.wikidata.org/wiki/Q2427921","display_name":"Supramolecular assembly","level":4,"score":0.29030001163482666},{"id":"https://openalex.org/C137277065","wikidata":"https://www.wikidata.org/wiki/Q2915446","display_name":"Non-covalent interactions","level":4,"score":0.27379998564720154},{"id":"https://openalex.org/C73922627","wikidata":"https://www.wikidata.org/wiki/Q754943","display_name":"Single crystal","level":2,"score":0.266400009393692},{"id":"https://openalex.org/C2778530040","wikidata":"https://www.wikidata.org/wiki/Q1937315","display_name":"Helix (gastropod)","level":3,"score":0.25380000472068787},{"id":"https://openalex.org/C84947059","wikidata":"https://www.wikidata.org/wiki/Q5191417","display_name":"Crystal structure prediction","level":3,"score":0.2506999969482422}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1107/s2056989026010406","doi":"https://doi.org/10.1107/s2056989026010406","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s2056989026010406","pdf_url":"https://journals.iucr.org/e/issues/2026/11/00/nx2040/nx2040.pdf","source":{"id":"https://openalex.org/S2739106167","display_name":"Acta Crystallographica Section E Crystallographic Communications","issn_l":"2056-9890","issn":["2056-9890"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj","dongbi-c","jufo-1","norway-1","oarl","poland-20","russia-white-list-3"],"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 Crystallographic Communications","raw_type":"journal-article"}],"best_oa_location":{"id":"doi:10.1107/s2056989026010406","doi":"https://doi.org/10.1107/s2056989026010406","is_oa":true,"landing_page_url":"https://doi.org/10.1107/s2056989026010406","pdf_url":"https://journals.iucr.org/e/issues/2026/11/00/nx2040/nx2040.pdf","source":{"id":"https://openalex.org/S2739106167","display_name":"Acta Crystallographica Section E Crystallographic Communications","issn_l":"2056-9890","issn":["2056-9890"],"is_oa":true,"is_in_doaj":true,"is_core":true,"listed_in":["cwts-core","doaj","dongbi-c","jufo-1","norway-1","oarl","poland-20","russia-white-list-3"],"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 Crystallographic Communications","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320318622","display_name":"Ministerul Cercet\u0103rii, Inov\u0103rii \u015fi Digitaliz\u0103rii","ror":null},{"id":"https://openalex.org/F4320323983","display_name":"Unitatea Executiva pentru Finantarea Invatamantului Superior, a Cercetarii, Dezvoltarii si Inovarii","ror":"https://ror.org/01q7jq182"},{"id":"https://openalex.org/F4320324615","display_name":"Ministry of Education and Science of Ukraine","ror":"https://ror.org/03bra4w96"},{"id":"https://openalex.org/F4320336189","display_name":"Colegiul Consultativ pentru Cercetare-Dezvoltare \u015fi Inovare","ror":"https://ror.org/03mc0m715"}],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W7223007904.pdf","grobid_xml":"https://content.openalex.org/works/W7223007904.grobid-xml"},"referenced_works_count":0,"referenced_works":[],"related_works":["https://openalex.org/W7203821777","https://openalex.org/W2163166687","https://openalex.org/W4205124434","https://openalex.org/W2891228090","https://openalex.org/W7159935332","https://openalex.org/W7203457013","https://openalex.org/W2529325721","https://openalex.org/W4413049839","https://openalex.org/W115504750","https://openalex.org/W7214920847"],"abstract_inverted_index":{"Amino":[0],"acid":[1,20],"salts":[2],"represent":[3],"a":[4,75],"diverse":[5],"class":[6],"of":[7,27,77,99,111],"molecular":[8],"solids":[9],"in":[10,47],"which":[11,69],"ionic":[12],"interactions":[13],"and":[14,22,79],"hydrogen":[15,81],"bonding":[16],"between":[17],"protonated":[18,66],"amino":[19],"species":[21],"counter-ions":[23],"govern":[24],"the":[25,48,88,92,97,100],"formation":[26],"supramolecular":[28],"architectures.":[29],"Phenylalanine":[30],"hydrobromide":[31],"(systematic":[32],"name:":[33],"1-carboxy-2-phenylethan-1-aminium":[34],"bromide,":[35],"C":[36],"9":[37],"H":[38],"12":[39],"NO":[40],"2":[41,54,56,58,116],"+":[42],"\u00b7Br":[43],"\u2212":[44],")":[45],"crystallizes":[46],"chiral":[49],"orthorhombic":[50],"space":[51],"group":[52],"P":[53],"1":[55,57,59],".":[60],"Its":[61],"structure":[62,104],"is":[63,105],"built":[64],"from":[65],"phenylalaninium":[67],"cations,":[68],"interact":[70],"with":[71,91],"bromide":[72],"anions":[73],"through":[74],"network":[76],"N\u2014H...Br":[78],"O\u2014H...Br":[80],"bonds,":[82],"forming":[83],"bilayers":[84],"propagating":[85],"parallel":[86],"to":[87],"ab":[89],"plane,":[90],"polar":[93],"groups":[94],"oriented":[95],"toward":[96],"interior":[98],"bilayers.":[101],"The":[102],"crystal":[103],"additionally":[106],"consolidated":[107],"by":[108],"three":[109],"types":[110],"weak":[112],"T-shaped":[113],"C(":[114],"sp":[115],")\u2014H...\u03c0":[117],"interactions.":[118]},"counts_by_year":[],"updated_date":"2026-11-08T12:12:28.789561","created_date":"2026-10-21T00:00:00"}