Electronic structure of some pesticides (CROSBI ID 573483)
Prilog sa skupa u zborniku | sažetak izlaganja sa skupa | domaća recenzija
Podaci o odgovornosti
Kovač, Branka ; Novak, I.
engleski
Electronic structure of some pesticides
The electronic structures of chemical pesticides: lindane (I), aldrin (II), dieldrin (III), diazinon (IV) and bromoxynil (V) have been investigated by UV photoelectron spectroscopy (UPS), quantum chemical calculations and virtual docking and molecular dynamics studies. Their electronic and molecular structures together with chemical reactivity are discussed in order to rationalize their biological activity as pesticides. This is the first reported attempt to rationalize the results of macroscopic studies of biological activity of pesticides in terms of molecular mechanisms of their activity based on electronic and molecular structures.
electronic structure; pesticides
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Podaci o prilogu
152-152.
2011.
objavljeno
Podaci o matičnoj publikaciji
XXII. HRVATSKI SKUP KEMIČARA I KEMIJSKIH INŽENJERA/ Knjiga sažetaka
Tomašić Vesna ; Maduna Valkaj Karolina (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI) ; Hrvatsko kemijsko drustvo
978-953-6894-42-0
Podaci o skupu
XXII.Hrvatski skup kemičara i kemijskih inženjera
poster
13.02.2011-16.02.2011
Zagreb, Hrvatska