1-(2,4-Difluorobenzyl)-6-{[3-(Trifluoromethyl)-2-Pyridinyl]Oxy}-4(1H)-Quinazolinone

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Properties Simple | Detailed

Formula C21H13F5N3O2+
IUPAC Name 1-[(2,4-difluorophenyl)methyl]-6-[[3-(trifluoromethyl)-2-pyridyl]oxy]quinazolin-1-ium-3-id-4-one
Molecular Mass 434.339 g·mol−1
Heat of Formation -911.2 ± 16.7 kJ·mol−1
Dipole Moment 7.05 ± 1.08 D
Volume 443.65 Å 3
Surface Area 383.44 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy 1.91 ± eV
Point Group Symmetry C1
InChIKey SWXDHFLZCMRYEP-UHFFFAOYSA-N
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