LEADER 01796nam  2200445z- 450 
001 9910346944403321
005 20210212
010   $a1000005428
035   $a(CKB)4920000000101078
035   $a(oapen)https://directory.doabooks.org/handle/20.500.12854/60875
035   $a(oapen)doab60875
035   $a(EXLCZ)994920000000101078
100   $a20202102d2006      |y         0
101 0 $aeng
135   $aurmn|---annan
181   $ctxt$2rdacontent
182   $cc$2rdamedia
183   $acr$2rdacarrier
200 00$aThermochemistry and Kinetics for the Oxidative Degradation of Dibenzofuran and Precursors
210   $cKIT Scientific Publishing$d2006
215   $a1 online resource (VIII, 219 p. p.)
311 08$a3-86644-085-5 
330   $aThe emission of dibenzofurans and dioxins from industrial processes is a major environmental concern. Focussing on dibenzofuran, this study tend to improve our understanding of the general oxidation chemistry and to provide a mechanism suitable for future modelling studies.Based on quantum chemical methods, energies, chemical structures and reactions are calculated numerically. Not only stable molecules and radicals, but also transition states are reported in this work.
606   $aChemistry$2bicssc
610   $aab initio
610   $aDFT
610   $aDibenzofuran
610   $aDioxin
610   $aGroupe additivity
610   $aIsodesmic reactions
610   $aKinetics
610   $aQRRK
610   $aThermochemistry
610   $aTransition state theory
615  7$aChemistry
700   $aSebbar$b Nadia$4auth$01279660
906   $aBOOK
912   $a9910346944403321
996   $aThermochemistry and Kinetics for the Oxidative Degradation of Dibenzofuran and Precursors$93015800
997   $aUNINA