Pregled bibliografske jedinice broj: 941587
Electronic structure and tautomerism of thioamides
Electronic structure and tautomerism of thioamides // Journal of electron spectroscopy and related phenomena, 209 (2016), 62-65 doi:10.1016/j.elspec.2016.03.005 (međunarodna recenzija, članak, znanstveni)
CROSBI ID: 941587 Za ispravke kontaktirajte CROSBI podršku putem web obrasca
Naslov
Electronic structure and tautomerism of thioamides
Autori
Novak, Igor ; Klasinc, Leo ; McGlynn, Sean P.
Izvornik
Journal of electron spectroscopy and related phenomena (0368-2048) 209
(2016);
62-65
Vrsta, podvrsta i kategorija rada
Radovi u časopisima, članak, znanstveni
Ključne riječi
Photoelectron spectroscopy ; Thioamides ; Cooperative catalysis
Sažetak
The electronic structures of several thioamides have been studied by UV photoelectron spectroscopy (UPS). The relative stabilities of keto-enol tautomers have been determined using high-level ab initio calculations and the results were used in the analysis of UPS spectra. The main features of electronic structure and tautomerism of thioamide derivatives are discussed. The predominant tautomers in the gas phase are of keto-(thio)keto form. The addition of cyclohexanone moiety to the thioamide group enhances the Lewis base character of the sulfur atom. The addition of phenyl group to the (thio)amide group significantly affects its electronic structure
Izvorni jezik
Engleski
Znanstvena područja
Kemija
POVEZANOST RADA
Projekti:
098-0982915-2945 - Spektroskopija, kemijska svojstva i reakcije biološki aktivnih molekula (Kovač, Branka, MZOS ) ( CroRIS)
Ustanove:
Institut "Ruđer Bošković", Zagreb
Profili:
Leo Klasinc
(autor)
Citiraj ovu publikaciju:
Časopis indeksira:
- Current Contents Connect (CCC)
- Web of Science Core Collection (WoSCC)
- Science Citation Index Expanded (SCI-EXP)
- SCI-EXP, SSCI i/ili A&HCI
- Scopus
