1-(2,4,6-Trifluorobenzyl)-6-[2-(Trifluoromethyl)Phenoxy]-4(1H)-Quinazolinone

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Formula C22H13F6N2O2+
IUPAC Name 6-[2-(trifluoromethyl)phenoxy]-1-[(2,4,6-trifluorophenyl)methyl]quinazolin-1-ium-3-id-4-one
Molecular Mass 451.341 g·mol−1
Heat of Formation -1137.6 ± 16.7 kJ·mol−1
Dipole Moment 8.32 ± 1.08 D
Volume 458.32 Å 3
Surface Area 385.87 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy 1.56 ± eV
Point Group Symmetry C1
InChIKey SELQSCGULJIZPA-UHFFFAOYSA-N
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