prikaz prve stranice dokumenta Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze
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doctoral thesis
Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze
Zagreb: University of Zagreb, Faculty of Science, 2020. urn:nbn:hr:217:777876
Bedeković, Nikola
University of Zagreb
Faculty of Science
Department of Chemistry

Institutional repository: Repository of the Faculty of Science

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Bedeković, N. (2020). Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze (Doctoral thesis). Zagreb: University of Zagreb, Faculty of Science. Retrieved from https://urn.nsk.hr/urn:nbn:hr:217:777876

Bedeković, Nikola. "Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze." Doctoral thesis, University of Zagreb, Faculty of Science, 2020. https://urn.nsk.hr/urn:nbn:hr:217:777876

Bedeković, Nikola. "Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze." Doctoral thesis, University of Zagreb, Faculty of Science, 2020. https://urn.nsk.hr/urn:nbn:hr:217:777876

Bedeković, N. (2020). 'Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze', Doctoral thesis, University of Zagreb, Faculty of Science, accessed 31 December 2024, https://urn.nsk.hr/urn:nbn:hr:217:777876

Bedeković N. Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze [Doctoral thesis]. Zagreb: University of Zagreb, Faculty of Science; 2020 [cited 2024 December 31] Available at: https://urn.nsk.hr/urn:nbn:hr:217:777876

N. Bedeković, "Kokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze", Doctoral thesis, University of Zagreb, Faculty of Science, Zagreb, 2020. Available at: https://urn.nsk.hr/urn:nbn:hr:217:777876

Metadata
TitleKokristalizacija perfluoriranih jodbenzenâ s jednostavnim derivatima piridina – komparativna evaluacija klasičnih donora halogenske veze
Title (english)Cocrystallization of perfluoroiodobenzenes with simple pyridine derivatives – comparative evaluation of classical halogen bond donors
AuthorNikola Bedeković
MentorVladimir Stilinović (mentor)
Committee memberMarijana Đaković (predsjednik povjerenstva)
Committee memberMario Cetina (član povjerenstva)
Committee memberKrešimir Molčanov (član povjerenstva)
GranterUniversity of Zagreb
Faculty of Science
(Department of Chemistry)
Zagreb
Defense date and country2020-07-10, Croatia
Scientific / art field,
discipline and subdiscipline		NATURAL SCIENCES
Chemistry
Universal decimal classification
(UDC)		54 - Chemistry. Crystallography. Mineralogy
Abstract
U sklopu disertacije pripravljeno je 37 novih kokristala jodperfluorbenzenâ i jednostavnih derivata piridina koji su strukturno i termički okarakterizirani. Po prvi puta su sustavno ispitana i uspoređena donorska svojstva komercijalnih jodperfluorbenzenâ i uočene su sličnosti i razlike u strukturama njihovih kokristala s jednostavnim derivatima piridina. Potvrđena je teza o 1,4-dijodtetrafluorbenzenu kao provjerenom i pouzdanom donoru halogenske veze koji tvori kokristale s 13 korištenih akceptora, dok je s 1,2-dijodtetrafluorbenzenom pripravljeno samo 5 kokristala. Ispitan je međuodnos geometrije molekula donora, iznosa elektrostatskih potencijala na donorskim atomima i prostornih ograničenja na nastajanje kokristala te njihov utjecaj na konačnu stehiometriju produkta. Također, bazičnost molekulâ akceptora istaknula se kao iznimno bitan faktor za pripravu kokristala s nešto slabijim donorima te kokristala s tritopičnim donorom halogenske veze, u kojemu su na molekulu donora vezane tri molekule akceptora.
Abstract (english)
In this study, 37 novel cocrystals of iodoperfluorobenzenes and simple pyridine derivatives were prepared and structurally and thermally characterized. For the first time, donor properties of commercial iodoperfluorobenzenes were systematically examined and compared, and similarities and differences in their cocrystal structures with simple pyridine derivatives were observed. 1,4-diiodotetrafluorobenzene was proven as a reliable halogen bond donor with a total of 13 prepared cocrystals, while 1,2-diiodotetrafluorobenzene forms cocrystals with only 5 used acceptors. The relationship between the geometry of donor molecules, electrostatic potentials at the donor atoms and the steric effects on the formation of cocrystals was investigated as well as their influence on the final product stoichiometry. Additionally, the basicity of acceptor molecules has emerged as a highly important factor for the preparation of cocrystals with slightly weaker donors and for the synthesis of cocrystals with a tritopic halogen bond donor, in which three acceptor molecules are attached to the donor molecule.
Keywords
Keywords (english)
Languagecroatian
URN:NBNurn:nbn:hr:217:777876
Promotion2020
Study programmeTitle: Doctoral study in chemistry
Study programme type: university
Study level: postgraduate
Academic / professional title: doktor/doktorica znanosti, područje prirodnih znanosti, polje kemija (doktor/doktorica znanosti, područje prirodnih znanosti, polje kemija)
Type of resourceText
Extent174 str. ; 30 cm
File originBorn digital
Access conditionsOpen access
Embargo expiration date: 2022-07-10
Terms of useLicence In copyright icon
Created on2020-07-20 12:27:00