Formula |
C23H13F6N3O3 |
IUPAC Name |
3-[4-oxo-1-[(2,4,6-trifluorophenyl)methyl]quinazolin-1-ium-3-id-6-yl]oxy-2-(trifluoromethyl)benzamide |
Molecular Mass |
493.358 g·mol−1 |
Heat of Formation |
-1303.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
11.88 ± 1.08 D |
Volume |
496.26 Å 3 |
Surface Area |
417.01 Å 2 |
HOMO Energy |
-9.35 ± 0.55 eV |
LUMO Energy |
-1.51 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UJEKCTGHTGBATO-UHFFFAOYSA-N |
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Elements |
H
C
F
O
N
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