Pregled bibliografske jedinice broj: 774189
Kinetics of formation of polybenzene azodioxide
Kinetics of formation of polybenzene azodioxide // Math/Chem/Comp
Dubrovnik, Hrvatska, 2015. (poster, nije recenziran, sažetak, znanstveni)
CROSBI ID: 774189 Za ispravke kontaktirajte CROSBI podršku putem web obrasca
Naslov
Kinetics of formation of polybenzene azodioxide
Autori
Bibulić, Petar ; Rončević, Igor ; Varga, Katarina ; Mihalić, Zlatko
Vrsta, podvrsta i kategorija rada
Sažeci sa skupova, sažetak, znanstveni
Skup
Math/Chem/Comp
Mjesto i datum
Dubrovnik, Hrvatska, 12.06.2015. - 18.06.2015
Vrsta sudjelovanja
Poster
Vrsta recenzije
Nije recenziran
Ključne riječi
nitroso; solid-state; polymerization; fragment molecular orbitals;
(nitroso; solid-state; polymerization; fragment molecular orbitals)
Sažetak
Formation of azodioxide bonds in polymerization of 1, 4-dinitrosobenzene was examined experimentally and computationally. While monomers prepared by UV dissociation produced exclusively E-isomers, Z-isomers were formed by polymerization of monomers deposited on CsI window. DFT method was used for shorter oligomeres, while Fragment Molecular Orbitals method was used for longer ones and showed good correlation with DFT.
Izvorni jezik
Engleski
Znanstvena područja
Kemija
POVEZANOST RADA
Projekti:
HRZZ-IP-2013-11-7444 - Organske molekule u kondenziranoj fazi: međudjelovanja i modeliranje (ORGMOL) (Vančik, Hrvoj, HRZZ - 2013-11) ( CroRIS)
Ustanove:
Prirodoslovno-matematički fakultet, Zagreb
