{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,3,17]],"date-time":"2026-03-17T05:25:38Z","timestamp":1773725138403,"version":"3.50.1"},"reference-count":65,"publisher":"American Chemical Society (ACS)","issue":"29","license":[{"start":{"date-parts":[[2025,7,15]],"date-time":"2025-07-15T00:00:00Z","timestamp":1752537600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2025,7,15]],"date-time":"2025-07-15T00:00:00Z","timestamp":1752537600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2025,7,15]],"date-time":"2025-07-15T00:00:00Z","timestamp":1752537600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/100019180","name":"HORIZON EUROPE European Research Council","doi-asserted-by":"publisher","award":["Horizon-Widera-2023-Talents-01 ERA-Chair 1011848998"],"award-info":[{"award-number":["Horizon-Widera-2023-Talents-01 ERA-Chair 1011848998"]}],"id":[{"id":"10.13039\/100019180","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100008530","name":"European Regional Development Fund","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100008530","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001871","name":"Funda??o para a Ci?ncia e a Tecnologia","doi-asserted-by":"publisher","award":["2020.04467.BD"],"award-info":[{"award-number":["2020.04467.BD"]}],"id":[{"id":"10.13039\/501100001871","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001871","name":"Funda??o para a Ci?ncia e a Tecnologia","doi-asserted-by":"publisher","award":["2023.10449.CPCA.A2"],"award-info":[{"award-number":["2023.10449.CPCA.A2"]}],"id":[{"id":"10.13039\/501100001871","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001871","name":"Funda??o para a Ci?ncia e a Tecnologia","doi-asserted-by":"publisher","award":["2023.11222.PEX"],"award-info":[{"award-number":["2023.11222.PEX"]}],"id":[{"id":"10.13039\/501100001871","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001871","name":"Funda??o para a Ci?ncia e a Tecnologia","doi-asserted-by":"publisher","award":["PTDC\/QUI-QFI\/1880\/2020"],"award-info":[{"award-number":["PTDC\/QUI-QFI\/1880\/2020"]}],"id":[{"id":"10.13039\/501100001871","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001871","name":"Funda??o para a Ci?ncia e a Tecnologia","doi-asserted-by":"publisher","award":["UIDB\/00313\/2020"],"award-info":[{"award-number":["UIDB\/00313\/2020"]}],"id":[{"id":"10.13039\/501100001871","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001871","name":"Funda??o para a Ci?ncia e a Tecnologia","doi-asserted-by":"publisher","award":["UIDP\/00313\/2020"],"award-info":[{"award-number":["UIDP\/00313\/2020"]}],"id":[{"id":"10.13039\/501100001871","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100008425","name":"Conseller?a de Cultura, Educaci?n e Ordenaci?n Universitaria, Xunta de Galicia","doi-asserted-by":"publisher","award":["ED431G 2023\/03"],"award-info":[{"award-number":["ED431G 2023\/03"]}],"id":[{"id":"10.13039\/501100008425","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Org. Chem."],"published-print":{"date-parts":[[2025,7,25]]},"DOI":"10.1021\/acs.joc.5c01251","type":"journal-article","created":{"date-parts":[[2025,7,15]],"date-time":"2025-07-15T19:12:47Z","timestamp":1752606767000},"page":"10476-10486","source":"Crossref","is-referenced-by-count":2,"title":["Hydrogen Tunneling in Thiobenzamide: A Case Study on Tunneling Through High-Energy Barriers"],"prefix":"10.1021","volume":"90","author":[{"ORCID":"https:\/\/orcid.org\/0000-0002-7845-9415","authenticated-orcid":true,"given":"Jos\u00e9 P. L.","family":"Roque","sequence":"first","affiliation":[{"name":"University of Coimbra, CQC-IMS","place":["Coimbra, Portugal"]},{"name":"Department of Chemistry","place":["Coimbra, Portugal"]}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-8511-1230","authenticated-orcid":true,"given":"Cl\u00e1udio M.","family":"Nunes","sequence":"additional","affiliation":[{"name":"University of Coimbra, CQC-IMS","place":["Coimbra, Portugal"]},{"name":"Department of Chemistry","place":["Coimbra, Portugal"]}]},{"given":"Epole","family":"Ntungwe","sequence":"additional","affiliation":[{"name":"University of Coimbra, CQC-IMS","place":["Coimbra, Portugal"]},{"name":"Department of Chemistry","place":["Coimbra, Portugal"]}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-6468-1592","authenticated-orcid":true,"given":"Antonio","family":"Fern\u00e1ndez-Ramos","sequence":"additional","affiliation":[{"name":"Departamento de Qu\u00edmica F\u00edsica, Facultade de Qu\u00edmica","place":["Santiago de Compostela, Spain"]},{"name":"Universidade de Santiago de Compostela","place":["Santiago de Compostela, Spain"]}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-8264-6854","authenticated-orcid":true,"given":"Rui","family":"Fausto","sequence":"additional","affiliation":[{"name":"University of Coimbra, CQC-IMS","place":["Coimbra, Portugal"]},{"name":"Department of Chemistry","place":["Coimbra, Portugal"]},{"name":"Spectroscopy@IKU, Faculty Sciences and Letters, Department of Physics","place":["Bakirkoy, Turkey"]},{"name":"Istanbul Kultur University","place":["Bakirkoy, Turkey"]}]}],"member":"316","published-online":{"date-parts":[[2025,7,15]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1007\/BF01328377"},{"key":"ref2\/cit2","doi-asserted-by":"publisher","DOI":"10.1038\/d41586-025-00014-5"},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1063\/1.1510281"},{"key":"ref4\/cit4","doi-asserted-by":"crossref","DOI":"10.1007\/978-1-4899-2891-7","volume-title":"The Tunnel Effect in Chemistry","author":"Bell R. P.","year":"1980"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1016\/j.trechm.2020.08.006"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1021\/acscentsci.3c00926"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1039\/D1CS01026C"},{"key":"ref8\/cit8","first-page":"1","volume-title":"Tunnelling in Molecules: Nuclear Quantum Effects from Bio to Physical Chemistry","author":"Nunes C. M.","year":"2021"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1002\/anie.202309717"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1002\/chem.202102010"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1039\/D2SC05388H"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1002\/ceur.202400060"},{"key":"ref13\/cit13","doi-asserted-by":"publisher","DOI":"10.1021\/acs.joc.3c00484"},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1002\/chem.202401323"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1016\/j.saa.2024.124139"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1039\/D4CP02799J"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.7b06035"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1126\/science.1203761"},{"key":"ref19\/cit19","doi-asserted-by":"publisher","DOI":"10.1002\/anie.201705140"},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.2c09026"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.9b02272"},{"key":"ref22\/cit22","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jpclett.7b00461"},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1126\/science.abq8663"},{"key":"ref24\/cit24","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.1235"},{"key":"ref26\/cit26","doi-asserted-by":"publisher","DOI":"10.1021\/jacs.6b07368"},{"key":"ref27\/cit27","doi-asserted-by":"publisher","DOI":"10.1039\/C8CP01703D"},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1021\/jp034684j"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1039\/C8SC03720E"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1021\/ja9107885"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1038\/nature07010"},{"key":"ref32\/cit32","doi-asserted-by":"crossref","first-page":"125","DOI":"10.1002\/9780470116449.ch3","volume-title":"Reviews in Computational Chemistry","author":"Fernandez-Ramos A.","year":"2007"},{"key":"ref33\/cit33","doi-asserted-by":"publisher","DOI":"10.1039\/D0CP04857G"},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1016\/j.tet.2016.09.029"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1002\/cphc.202200396"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1002\/chem.202005188"},{"key":"ref38\/cit38","doi-asserted-by":"publisher","DOI":"10.1039\/C9CP03417J"},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.1039\/D4CP02400A"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.3891\/acta.chem.scand.16-1616"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1002\/poc.1663"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1039\/b104671n"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1021\/jp034259q"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.1165"},{"key":"ref45\/cit45","doi-asserted-by":"publisher","DOI":"10.1063\/1.1334616"},{"key":"ref46\/cit46","doi-asserted-by":"publisher","DOI":"10.1063\/1.464913"},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevB.37.785"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1139\/p80-159"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1063\/1.447079"},{"key":"ref50\/cit50","unstructured":"Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Petersson, G. A.; Nakatsuji, H.; Li, X.; Caricato, M.; Marenich, A. V.; Bloino, J.; Janesko, B. G.; Gomperts, R.; Mennucci, B.; Hratchian, H. P.; Ortiz, J. V.; Izmaylov, A. F.; Sonnenberg, J. L.; Williams-Young, D.; Ding, F.; Lipparini, F.; Egidi, F.; Goings, J.; Peng, B.; Petrone, A.; Henderson, T.; Ranasinghe, D.; Zakrzewski, V. G.; Gao, J.; Rega, N.; Zheng, G.; Liang, W.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Throssell, K.; Montgomery, J. A., Jr.; Peralta, J. E.; Ogliaro, F.; Bearpark, M. J.; Heyd, J. J.; Brothers, E. N.; Kudin, K. N.; Staroverov, V. N.; Keith, T. A.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A. P.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Millam, J. M.; Klene, M.; Adamo, C.; Cammi, R.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Farkas, O.; Foresman, J. B.; Fox, D. J. Gaussian 16. Revision B.01; Gaussian, Inc.: Wallingford CT, 2016."},{"key":"ref51\/cit51","volume-title":"BALGA- Computer Program for PED Calculation","author":"Lapinski L."},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1021\/ja00504a009"},{"key":"ref53\/cit53","doi-asserted-by":"publisher","DOI":"10.1021\/jp048147q"},{"key":"ref54\/cit54","doi-asserted-by":"publisher","DOI":"10.1063\/1.1677527"},{"key":"ref55\/cit55","doi-asserted-by":"publisher","DOI":"10.1063\/1.2817618"},{"key":"ref56\/cit56","doi-asserted-by":"publisher","DOI":"10.1063\/1.3308483"},{"key":"ref57\/cit57","doi-asserted-by":"publisher","DOI":"10.1063\/1.454172"},{"key":"ref58\/cit58","doi-asserted-by":"publisher","DOI":"10.1021\/jp9724028"},{"key":"ref59\/cit59","doi-asserted-by":"publisher","DOI":"10.1021\/ct100326h"},{"key":"ref60\/cit60","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.82"},{"key":"ref61\/cit61","doi-asserted-by":"publisher","DOI":"10.1016\/j.cpc.2020.107457"},{"key":"ref62\/cit62","doi-asserted-by":"publisher","DOI":"10.1021\/j150621a001"},{"key":"ref63\/cit63","doi-asserted-by":"publisher","DOI":"10.1021\/ja00059a041"},{"key":"ref64\/cit64","volume-title":"Polyrate-Version 2023","author":"Meana-Pa\u00f1eda R.","year":"2024"},{"key":"ref65\/cit65","doi-asserted-by":"publisher","DOI":"10.1021\/ct050153i"},{"key":"ref66\/cit66","doi-asserted-by":"publisher","DOI":"10.1063\/1.1329893"},{"key":"ref67\/cit67","first-page":"1","volume-title":"Theoretical and Computational Approaches to Interface Phenomena","author":"Wonchoba S. E.","year":"1994"}],"container-title":["The Journal of Organic Chemistry"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.joc.5c01251","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.joc.5c01251","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2025,7,28]],"date-time":"2025-07-28T12:03:18Z","timestamp":1753704198000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.joc.5c01251"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2025,7,15]]},"references-count":65,"journal-issue":{"issue":"29","published-print":{"date-parts":[[2025,7,25]]}},"alternative-id":["10.1021\/acs.joc.5c01251"],"URL":"https:\/\/doi.org\/10.1021\/acs.joc.5c01251","relation":{},"ISSN":["0022-3263","1520-6904"],"issn-type":[{"value":"0022-3263","type":"print"},{"value":"1520-6904","type":"electronic"}],"subject":[],"published":{"date-parts":[[2025,7,15]]}}}