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Pregled bibliografske jedinice broj: 1026290

Ferrocenyl lithium reacts with phthalimide. DFT study of the mechanism


Šakić, Davor; Vrček, Valerije; Hildebrandt, Alexander
Ferrocenyl lithium reacts with phthalimide. DFT study of the mechanism // Humboldt College, Science and Educational Challenges Facing Europe in the Next Decade / Ivanda, Mile ; Skenderović, Hrvoje (ur.).
Zagreb: Klub hrvatskih humboldtovaca, 2019. str. 61-61 (poster, domaća recenzija, sažetak, znanstveni)


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Naslov
Ferrocenyl lithium reacts with phthalimide. DFT study of the mechanism

Autori
Šakić, Davor ; Vrček, Valerije ; Hildebrandt, Alexander

Vrsta, podvrsta i kategorija rada
Sažeci sa skupova, sažetak, znanstveni

Izvornik
Humboldt College, Science and Educational Challenges Facing Europe in the Next Decade / Ivanda, Mile ; Skenderović, Hrvoje - Zagreb : Klub hrvatskih humboldtovaca, 2019, 61-61

ISBN
978-953-97333-6-8

Skup
SCIENCE AND EDUCATIONAL CHALLENGES FACING EUROPE IN THE NEXT DECADE

Mjesto i datum
Zagreb, Hrvatska, 10-11.10.2019

Vrsta sudjelovanja
Poster

Vrsta recenzije
Domaća recenzija

Ključne riječi
organometallics, ferrocene, phthalimide, DFT, reaction mechanism

Sažetak
In order to investigate the electronic and structural interactions between organometallic functionalities and heterocycles, a reaction between ferrocenyl lithium (FcLi) and Nphenyl phthalimide was performed. During the course of this reaction an unusual reactivity was observed. The conversion of one equivalent of FcLi with N-phenyl phthalimide, resulted in mono-ferrocenyl lactam, which rapidly undergoes ring-chain tautomerism. When two equivalents of FcLi were used, a bis-ferrocenyl lactone, involving a five-membered oxygen bridged heterocycle, was formed. In addition, a tricyclic product, in which one of the ferrocene moieties displays a planar chiral substitution pattern, was isolated. This complex reaction mechanism has been explored by use of modern computational techniques

Izvorni jezik
Engleski

Znanstvena područja
Kemija, Farmacija



POVEZANOST RADA


Projekti:
HRZZ-IP-2016-06-1137 - Kvantno-kemijski dizajn, priprava i biološka svojstva organometalnih derivata nukleobaza (OrDeN) (Vrček, Valerije, HRZZ - 2016-06) ( POIROT)

Ustanove:
Farmaceutsko-biokemijski fakultet, Zagreb

Profili:

Avatar Url Davor Šakić (autor)

Avatar Url Valerije Vrček (autor)

Citiraj ovu publikaciju

Šakić, Davor; Vrček, Valerije; Hildebrandt, Alexander
Ferrocenyl lithium reacts with phthalimide. DFT study of the mechanism // Humboldt College, Science and Educational Challenges Facing Europe in the Next Decade / Ivanda, Mile ; Skenderović, Hrvoje (ur.).
Zagreb: Klub hrvatskih humboldtovaca, 2019. str. 61-61 (poster, domaća recenzija, sažetak, znanstveni)
Šakić, D., Vrček, V. & Hildebrandt, A. (2019) Ferrocenyl lithium reacts with phthalimide. DFT study of the mechanism. U: Ivanda, M. & Skenderović, H. (ur.)Humboldt College, Science and Educational Challenges Facing Europe in the Next Decade.
@article{article, year = {2019}, pages = {61-61}, keywords = {organometallics, ferrocene, phthalimide, DFT, reaction mechanism}, isbn = {978-953-97333-6-8}, title = {Ferrocenyl lithium reacts with phthalimide. DFT study of the mechanism}, keyword = {organometallics, ferrocene, phthalimide, DFT, reaction mechanism}, publisher = {Klub hrvatskih humboldtovaca}, publisherplace = {Zagreb, Hrvatska} }
@article{article, year = {2019}, pages = {61-61}, keywords = {organometallics, ferrocene, phthalimide, DFT, reaction mechanism}, isbn = {978-953-97333-6-8}, title = {Ferrocenyl lithium reacts with phthalimide. DFT study of the mechanism}, keyword = {organometallics, ferrocene, phthalimide, DFT, reaction mechanism}, publisher = {Klub hrvatskih humboldtovaca}, publisherplace = {Zagreb, Hrvatska} }




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