{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,20]],"date-time":"2026-09-20T11:11:35Z","timestamp":1789902695697,"version":"4.0.1"},"reference-count":52,"publisher":"AIP Publishing","issue":"23","funder":[{"DOI":"10.13039\/501100000780","name":"European Commission","doi-asserted-by":"publisher","award":["PIRSES-GA-2012-31754 and MOLIM COST ACTION CM1405"],"award-info":[{"award-number":["PIRSES-GA-2012-31754 and MOLIM COST ACTION CM1405"]}],"id":[{"id":"10.13039\/501100000780","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100002383","name":"King Saud University","doi-asserted-by":"publisher","award":["VPP"],"award-info":[{"award-number":["VPP"]}],"id":[{"id":"10.13039\/501100002383","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["pubs.aip.org"],"crossmark-restriction":true},"short-container-title":[],"published-print":{"date-parts":[[2016,6,21]]},"abstract":"<jats:p>Benchmark ab initio calculations are performed to investigate the stable isomers of [O,N,S,S]. These computations are carried out using coupled cluster (RCCSD(T)) and explicitly correlated coupled cluster methods (RCCSD(T)-F12). In addition to the already known cis isomer of SSNO, nine other stable forms are predicted. The most stable isomer is cis-OSNS. Nine structures are chain bent-bent with relatively large dipole moments which make them detectable, as cis-SSNO, by infrared, far-infrared, and microwave spectroscopies. We found also a C2v isomer (NS2O). Since these species are strongly suggested to play an important role as intermediates during the bioactive reaction products of the NO\/H2S interaction, the rotational and vibrational spectroscopic parameters are presented to help aid the in vivo identification and assignment of these spectra. Results from this work show that [O,N,S,S] may play key roles during nitric oxide transport and deliver in biological media, as well as, provide an explanation for the weak characteristic of disulfide bridges within proteins.<\/jats:p>","DOI":"10.1063\/1.4954062","type":"journal-article","created":{"date-parts":[[2016,6,22]],"date-time":"2016-06-22T14:20:25Z","timestamp":1466605225000},"update-policy":"https:\/\/doi.org\/10.1063\/aip-crossmark-policy-page","source":"Crossref","is-referenced-by-count":7,"title":["Toward the laboratory identification of [O,N,S,S] isomers: Implications for biological NO chemistry"],"prefix":"10.1063","volume":"144","author":[{"given":"Tarek","family":"Ayari","sequence":"first","affiliation":[{"name":"Universit\u00e9 Paris-Est 1 Laboratoire Mod\u00e9lisation et Simulation Multi Echelle, , MSME UMR 8208 CNRS, 5 Bd Descartes, 77454 Marne-la-Vall\u00e9e, France and Laboratoire de Spectroscopie Atomique, , Tunis, Tunisia"},{"name":"Mol\u00e9culaire et Applications\u2013LSAMA Universit\u00e9 de Tunis Al Manar 1 Laboratoire Mod\u00e9lisation et Simulation Multi Echelle, , MSME UMR 8208 CNRS, 5 Bd Descartes, 77454 Marne-la-Vall\u00e9e, France and Laboratoire de Spectroscopie Atomique, , Tunis, Tunisia"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Nejm-Eddine","family":"Jaidane","sequence":"additional","affiliation":[{"name":"Mol\u00e9culaire et Applications\u2013LSAMA Universit\u00e9 de Tunis Al Manar 2 Laboratoire de Spectroscopie Atomique, , Tunis, Tunisia"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Muneerah Mogren","family":"Al Mogren","sequence":"additional","affiliation":[{"name":"King Saud University 3 Chemistry Department, Faculty of Science, , P.O. Box 2455, Riyadh 11451, Kingdom of Saudi Arabia"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-5461-1486","authenticated-orcid":false,"given":"Joseph S.","family":"Francisco","sequence":"additional","affiliation":[{"name":"Purdue University 4 Department of Chemistry and Department of Earth and Atmospheric Sciences, , West Lafayette, Indiana 47906, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Majdi","family":"Hochlaf","sequence":"additional","affiliation":[{"name":"Universit\u00e9 Paris-Est 5 Laboratoire Mod\u00e9lisation et Simulation Multi Echelle, , MSME UMR 8208 CNRS, 5 Bd Descartes, 77454 Marne-la-Vall\u00e9e, France"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"317","published-online":{"date-parts":[[2016,6,21]]},"reference":[{"key":"2023063016404699900_c1","doi-asserted-by":"publisher","first-page":"1898","DOI":"10.1126\/science.1281928","volume":"258","year":"1992","journal-title":"Science"},{"key":"2023063016404699900_c2","doi-asserted-by":"publisher","first-page":"12016","DOI":"10.1021\/ja3009693","volume":"134","year":"2012","journal-title":"J. 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