Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts

Autores
Custodio Castro, Michelle Tatiana; Della Védova, Carlos Omar; Willner, Helge; Romano, Rosana Mariel
Año de publicación
2022
Idioma
inglés
Tipo de recurso
artículo
Estado
versión publicada
Descripción
In this work, prereactive complexes, reaction products, and conformational preferencesderived from the photochemical reaction between CS2and ClF were analyzed following the code-position of the reactants trapped in argon matrices at cryogenic temperatures. After codepositionof CS2and ClF diluted in Ar, the formation of van der Waals complexes is observed. When themixture is subsequently irradiated by means of broad-band UV-visible light (225≤λ≤800 nm),fluorothiocarbonylsulfenyl chloride (FC(S)SCl) and chlorothiocarbonylsulfenyl fluoride (ClC(S)SF)are produced. These species exist as two stable planar anti- and syn-conformers (anti- and syn- of theC=S double bond with respect to the S–Cl or S–F single bond, respectively). For both novel molecules,anti-FC(S)SCl and anti-ClC(S)SF are the lowest-energy computed rotamers. As expected due to thephotochemical activity of these species, additional reaction products due to alternative or subsequentphotochannels are formed during this process.
Centro de Química Inorgánica
Materia
Química
matrix-isolation
photochemistry
carbon disulfide
chloromonofluoride
Nivel de accesibilidad
acceso abierto
Condiciones de uso
http://creativecommons.org/licenses/by/4.0/
Repositorio
SEDICI (UNLP)
Institución
Universidad Nacional de La Plata
OAI Identificador
oai:sedici.unlp.edu.ar:10915/141544
Acceder
id SEDICI_9dc7d144b91ee95301505ef1971078c5
oai_identifier_str oai:sedici.unlp.edu.ar:10915/141544
network_acronym_str SEDICI
repository_id_str 1329
network_name_str SEDICI (UNLP)
spelling Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe PhotoproductsCustodio Castro, Michelle TatianaDella Védova, Carlos OmarWillner, HelgeRomano, Rosana MarielQuímicamatrix-isolationphotochemistrycarbon disulfidechloromonofluorideIn this work, prereactive complexes, reaction products, and conformational preferencesderived from the photochemical reaction between CS2and ClF were analyzed following the code-position of the reactants trapped in argon matrices at cryogenic temperatures. After codepositionof CS2and ClF diluted in Ar, the formation of van der Waals complexes is observed. When themixture is subsequently irradiated by means of broad-band UV-visible light (225≤λ≤800 nm),fluorothiocarbonylsulfenyl chloride (FC(S)SCl) and chlorothiocarbonylsulfenyl fluoride (ClC(S)SF)are produced. These species exist as two stable planar anti- and syn-conformers (anti- and syn- of theC=S double bond with respect to the S–Cl or S–F single bond, respectively). For both novel molecules,anti-FC(S)SCl and anti-ClC(S)SF are the lowest-energy computed rotamers. As expected due to thephotochemical activity of these species, additional reaction products due to alternative or subsequentphotochannels are formed during this process.Centro de Química Inorgánica2022-09-02info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionArticulohttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdf765-778http://sedici.unlp.edu.ar/handle/10915/141544enginfo:eu-repo/semantics/altIdentifier/issn/2673-7256info:eu-repo/semantics/altIdentifier/doi/10.3390/photochem2030049info:eu-repo/semantics/openAccesshttp://creativecommons.org/licenses/by/4.0/Creative Commons Attribution 4.0 International (CC BY 4.0)reponame:SEDICI (UNLP)instname:Universidad Nacional de La Platainstacron:UNLP2025-10-15T11:27:46Zoai:sedici.unlp.edu.ar:10915/141544Institucionalhttp://sedici.unlp.edu.ar/Universidad públicaNo correspondehttp://sedici.unlp.edu.ar/oai/snrdalira@sedici.unlp.edu.arArgentinaNo correspondeNo correspondeNo correspondeopendoar:13292025-10-15 11:27:46.445SEDICI (UNLP) - Universidad Nacional de La Platafalse
dc.title.none.fl_str_mv Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
title Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
spellingShingle Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
Custodio Castro, Michelle Tatiana
Química
matrix-isolation
photochemistry
carbon disulfide
chloromonofluoride
title_short Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
title_full Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
title_fullStr Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
title_full_unstemmed Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
title_sort Ar-Matrix Studies of the Photochemical Reaction between CS2and ClF: Prereactive Complexes and Bond Isomerism ofthe Photoproducts
dc.creator.none.fl_str_mv Custodio Castro, Michelle Tatiana
Della Védova, Carlos Omar
Willner, Helge
Romano, Rosana Mariel
author Custodio Castro, Michelle Tatiana
author_facet Custodio Castro, Michelle Tatiana
Della Védova, Carlos Omar
Willner, Helge
Romano, Rosana Mariel
author_role author
author2 Della Védova, Carlos Omar
Willner, Helge
Romano, Rosana Mariel
author2_role author
author
author
dc.subject.none.fl_str_mv Química
matrix-isolation
photochemistry
carbon disulfide
chloromonofluoride
topic Química
matrix-isolation
photochemistry
carbon disulfide
chloromonofluoride
dc.description.none.fl_txt_mv In this work, prereactive complexes, reaction products, and conformational preferencesderived from the photochemical reaction between CS2and ClF were analyzed following the code-position of the reactants trapped in argon matrices at cryogenic temperatures. After codepositionof CS2and ClF diluted in Ar, the formation of van der Waals complexes is observed. When themixture is subsequently irradiated by means of broad-band UV-visible light (225≤λ≤800 nm),fluorothiocarbonylsulfenyl chloride (FC(S)SCl) and chlorothiocarbonylsulfenyl fluoride (ClC(S)SF)are produced. These species exist as two stable planar anti- and syn-conformers (anti- and syn- of theC=S double bond with respect to the S–Cl or S–F single bond, respectively). For both novel molecules,anti-FC(S)SCl and anti-ClC(S)SF are the lowest-energy computed rotamers. As expected due to thephotochemical activity of these species, additional reaction products due to alternative or subsequentphotochannels are formed during this process.
Centro de Química Inorgánica
description In this work, prereactive complexes, reaction products, and conformational preferencesderived from the photochemical reaction between CS2and ClF were analyzed following the code-position of the reactants trapped in argon matrices at cryogenic temperatures. After codepositionof CS2and ClF diluted in Ar, the formation of van der Waals complexes is observed. When themixture is subsequently irradiated by means of broad-band UV-visible light (225≤λ≤800 nm),fluorothiocarbonylsulfenyl chloride (FC(S)SCl) and chlorothiocarbonylsulfenyl fluoride (ClC(S)SF)are produced. These species exist as two stable planar anti- and syn-conformers (anti- and syn- of theC=S double bond with respect to the S–Cl or S–F single bond, respectively). For both novel molecules,anti-FC(S)SCl and anti-ClC(S)SF are the lowest-energy computed rotamers. As expected due to thephotochemical activity of these species, additional reaction products due to alternative or subsequentphotochannels are formed during this process.
publishDate 2022
dc.date.none.fl_str_mv 2022-09-02
dc.type.none.fl_str_mv info:eu-repo/semantics/article
info:eu-repo/semantics/publishedVersion
Articulo
http://purl.org/coar/resource_type/c_6501
info:ar-repo/semantics/articulo
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv http://sedici.unlp.edu.ar/handle/10915/141544
url http://sedici.unlp.edu.ar/handle/10915/141544
dc.language.none.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv info:eu-repo/semantics/altIdentifier/issn/2673-7256
info:eu-repo/semantics/altIdentifier/doi/10.3390/photochem2030049
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
http://creativecommons.org/licenses/by/4.0/
Creative Commons Attribution 4.0 International (CC BY 4.0)
eu_rights_str_mv openAccess
rights_invalid_str_mv http://creativecommons.org/licenses/by/4.0/
Creative Commons Attribution 4.0 International (CC BY 4.0)
dc.format.none.fl_str_mv application/pdf
765-778
dc.source.none.fl_str_mv reponame:SEDICI (UNLP)
instname:Universidad Nacional de La Plata
instacron:UNLP
reponame_str SEDICI (UNLP)
collection SEDICI (UNLP)
instname_str Universidad Nacional de La Plata
instacron_str UNLP
institution UNLP
repository.name.fl_str_mv SEDICI (UNLP) - Universidad Nacional de La Plata
repository.mail.fl_str_mv alira@sedici.unlp.edu.ar
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score 13.22299

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