Electronic spectrum of the protonated diacetylene cation (H2C4H(+)).
Identifieur interne : 000674 ( PubMed/Corpus ); précédent : 000673; suivant : 000675Electronic spectrum of the protonated diacetylene cation (H2C4H(+)).
Auteurs : Katherine J. Catani ; Giel Muller ; Pavol Jusko ; Patrice Theulé ; Evan J. Bieske ; Christophe JouvetSource :
- The Journal of chemical physics [ 1089-7690 ] ; 2017.
Abstract
The B̃(1)A1←X̃(1)A1 electronic band system of the protonated diacetylene cation (H2C4H(+)) is measured over the 230-295 nm range by photodissociating H2C4H(+) ions stored in a cryogenic ion trap and by photodissociating H2C4H(+) tagged with Ar and N2 in a tandem mass spectrometer. The B̃(1)A1←X̃(1)A1 band system has an origin at 34 941 cm(-1) for H2C4H(+), 34 934 cm(-1) for H2C4H(+)-Ar, and 34 920 cm(-1) for H2C4H(+)-N2. The spectra of H2C4H(+), H2C4H(+)-Ar, and H2C4H(+)-N2 display similar vibronic structure, which is assigned using ab initio calculations to progressions in two symmetric a1 C-C stretch vibrational modes (ν6 and ν4), with band spacings of 860 and 1481 cm(-1), respectively.
DOI: 10.1063/1.4990572
PubMed: 28863531
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Catani</name><affiliation><nlm:affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</nlm:affiliation></affiliation></author><author><name sortKey="Muller, Giel" sort="Muller, Giel" uniqKey="Muller G" first="Giel" last="Muller">Giel Muller</name><affiliation><nlm:affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</nlm:affiliation></affiliation></author><author><name sortKey="Jusko, Pavol" sort="Jusko, Pavol" uniqKey="Jusko P" first="Pavol" last="Jusko">Pavol Jusko</name><affiliation><nlm:affiliation>Physikalisches Institut, Universität zu Köln, Zülpicher Str. 77, 50937 Köln, Germany.</nlm:affiliation></affiliation></author><author><name sortKey="Theule, Patrice" sort="Theule, Patrice" uniqKey="Theule P" first="Patrice" last="Theulé">Patrice Theulé</name><affiliation><nlm:affiliation>CNRS, Aix Marseille Université, Physique des Interactions Ioniques et Moléculaires (PIIM) UMR 7345, 13397 Marseille Cedex, France.</nlm:affiliation></affiliation></author><author><name sortKey="Bieske, Evan J" sort="Bieske, Evan J" uniqKey="Bieske E" first="Evan J" last="Bieske">Evan J. Bieske</name><affiliation><nlm:affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</nlm:affiliation></affiliation></author><author><name sortKey="Jouvet, Christophe" sort="Jouvet, Christophe" uniqKey="Jouvet C" first="Christophe" last="Jouvet">Christophe Jouvet</name><affiliation><nlm:affiliation>CNRS, Aix Marseille Université, Physique des Interactions Ioniques et Moléculaires (PIIM) UMR 7345, 13397 Marseille Cedex, France.</nlm:affiliation></affiliation></author></titleStmt><publicationStmt><idno type="wicri:source">PubMed</idno><date when="2017">2017</date><idno type="RBID">pubmed:28863531</idno><idno type="pmid">28863531</idno><idno type="doi">10.1063/1.4990572</idno><idno type="wicri:Area/PubMed/Corpus">000674</idno><idno type="wicri:explorRef" wicri:stream="PubMed" wicri:step="Corpus" wicri:corpus="PubMed">000674</idno></publicationStmt><sourceDesc><biblStruct><analytic><title xml:lang="en">Electronic spectrum of the protonated diacetylene cation (H2C4H(+)).</title><author><name sortKey="Catani, Katherine J" sort="Catani, Katherine J" uniqKey="Catani K" first="Katherine J" last="Catani">Katherine J. Catani</name><affiliation><nlm:affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</nlm:affiliation></affiliation></author><author><name sortKey="Muller, Giel" sort="Muller, Giel" uniqKey="Muller G" first="Giel" last="Muller">Giel Muller</name><affiliation><nlm:affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</nlm:affiliation></affiliation></author><author><name sortKey="Jusko, Pavol" sort="Jusko, Pavol" uniqKey="Jusko P" first="Pavol" last="Jusko">Pavol Jusko</name><affiliation><nlm:affiliation>Physikalisches Institut, Universität zu Köln, Zülpicher Str. 77, 50937 Köln, Germany.</nlm:affiliation></affiliation></author><author><name sortKey="Theule, Patrice" sort="Theule, Patrice" uniqKey="Theule P" first="Patrice" last="Theulé">Patrice Theulé</name><affiliation><nlm:affiliation>CNRS, Aix Marseille Université, Physique des Interactions Ioniques et Moléculaires (PIIM) UMR 7345, 13397 Marseille Cedex, France.</nlm:affiliation></affiliation></author><author><name sortKey="Bieske, Evan J" sort="Bieske, Evan J" uniqKey="Bieske E" first="Evan J" last="Bieske">Evan J. Bieske</name><affiliation><nlm:affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</nlm:affiliation></affiliation></author><author><name sortKey="Jouvet, Christophe" sort="Jouvet, Christophe" uniqKey="Jouvet C" first="Christophe" last="Jouvet">Christophe Jouvet</name><affiliation><nlm:affiliation>CNRS, Aix Marseille Université, Physique des Interactions Ioniques et Moléculaires (PIIM) UMR 7345, 13397 Marseille Cedex, France.</nlm:affiliation></affiliation></author></analytic><series><title level="j">The Journal of chemical physics</title><idno type="eISSN">1089-7690</idno><imprint><date when="2017" type="published">2017</date></imprint></series></biblStruct></sourceDesc></fileDesc><profileDesc><textClass></textClass></profileDesc></teiHeader><front><div type="abstract" xml:lang="en">The B̃(1)A1←X̃(1)A1 electronic band system of the protonated diacetylene cation (H2C4H(+)) is measured over the 230-295 nm range by photodissociating H2C4H(+) ions stored in a cryogenic ion trap and by photodissociating H2C4H(+) tagged with Ar and N2 in a tandem mass spectrometer. The B̃(1)A1←X̃(1)A1 band system has an origin at 34 941 cm(-1) for H2C4H(+), 34 934 cm(-1) for H2C4H(+)-Ar, and 34 920 cm(-1) for H2C4H(+)-N2. The spectra of H2C4H(+), H2C4H(+)-Ar, and H2C4H(+)-N2 display similar vibronic structure, which is assigned using ab initio calculations to progressions in two symmetric a1 C-C stretch vibrational modes (ν6 and ν4), with band spacings of 860 and 1481 cm(-1), respectively.</div></front></TEI><pubmed><MedlineCitation Status="In-Data-Review" Owner="NLM"><PMID Version="1">28863531</PMID><DateCreated><Year>2017</Year><Month>09</Month><Day>02</Day></DateCreated><DateRevised><Year>2017</Year><Month>09</Month><Day>02</Day></DateRevised><Article PubModel="Print"><Journal><ISSN IssnType="Electronic">1089-7690</ISSN><JournalIssue CitedMedium="Internet"><Volume>147</Volume><Issue>8</Issue><PubDate><Year>2017</Year><Month>Aug</Month><Day>28</Day></PubDate></JournalIssue><Title>The Journal of chemical physics</Title><ISOAbbreviation>J Chem Phys</ISOAbbreviation></Journal><ArticleTitle>Electronic spectrum of the protonated diacetylene cation (H2C4H(+)).</ArticleTitle><Pagination><MedlinePgn>084302</MedlinePgn></Pagination><ELocationID EIdType="doi" ValidYN="Y">10.1063/1.4990572</ELocationID><Abstract><AbstractText>The B̃(1)A1←X̃(1)A1 electronic band system of the protonated diacetylene cation (H2C4H(+)) is measured over the 230-295 nm range by photodissociating H2C4H(+) ions stored in a cryogenic ion trap and by photodissociating H2C4H(+) tagged with Ar and N2 in a tandem mass spectrometer. The B̃(1)A1←X̃(1)A1 band system has an origin at 34 941 cm(-1) for H2C4H(+), 34 934 cm(-1) for H2C4H(+)-Ar, and 34 920 cm(-1) for H2C4H(+)-N2. The spectra of H2C4H(+), H2C4H(+)-Ar, and H2C4H(+)-N2 display similar vibronic structure, which is assigned using ab initio calculations to progressions in two symmetric a1 C-C stretch vibrational modes (ν6 and ν4), with band spacings of 860 and 1481 cm(-1), respectively.</AbstractText></Abstract><AuthorList CompleteYN="Y"><Author ValidYN="Y"><LastName>Catani</LastName><ForeName>Katherine J</ForeName><Initials>KJ</Initials><Identifier Source="ORCID">000000031524596X</Identifier><AffiliationInfo><Affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Muller</LastName><ForeName>Giel</ForeName><Initials>G</Initials><Identifier Source="ORCID">0000000311736825</Identifier><AffiliationInfo><Affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Jusko</LastName><ForeName>Pavol</ForeName><Initials>P</Initials><AffiliationInfo><Affiliation>Physikalisches Institut, Universität zu Köln, Zülpicher Str. 77, 50937 Köln, Germany.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Theulé</LastName><ForeName>Patrice</ForeName><Initials>P</Initials><AffiliationInfo><Affiliation>CNRS, Aix Marseille Université, Physique des Interactions Ioniques et Moléculaires (PIIM) UMR 7345, 13397 Marseille Cedex, France.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Bieske</LastName><ForeName>Evan J</ForeName><Initials>EJ</Initials><Identifier Source="ORCID">000000031848507X</Identifier><AffiliationInfo><Affiliation>School of Chemistry, The University of Melbourne, Victoria 3010, Australia.</Affiliation></AffiliationInfo></Author><Author ValidYN="Y"><LastName>Jouvet</LastName><ForeName>Christophe</ForeName><Initials>C</Initials><AffiliationInfo><Affiliation>CNRS, Aix Marseille Université, Physique des Interactions Ioniques et Moléculaires (PIIM) UMR 7345, 13397 Marseille Cedex, France.</Affiliation></AffiliationInfo></Author></AuthorList><Language>eng</Language><PublicationTypeList><PublicationType UI="D016428">Journal Article</PublicationType></PublicationTypeList></Article><MedlineJournalInfo><Country>United States</Country><MedlineTA>J Chem Phys</MedlineTA><NlmUniqueID>0375360</NlmUniqueID><ISSNLinking>0021-9606</ISSNLinking></MedlineJournalInfo></MedlineCitation><PubmedData><History><PubMedPubDate PubStatus="entrez"><Year>2017</Year><Month>9</Month><Day>3</Day><Hour>6</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="pubmed"><Year>2017</Year><Month>9</Month><Day>3</Day><Hour>6</Hour><Minute>0</Minute></PubMedPubDate><PubMedPubDate PubStatus="medline"><Year>2017</Year><Month>9</Month><Day>3</Day><Hour>6</Hour><Minute>0</Minute></PubMedPubDate></History><PublicationStatus>ppublish</PublicationStatus><ArticleIdList><ArticleId IdType="pubmed">28863531</ArticleId><ArticleId IdType="doi">10.1063/1.4990572</ArticleId></ArticleIdList></PubmedData></pubmed></record>Pour manipuler ce document sous Unix (Dilib)
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