Formula |
C23H18F3N5O3 |
IUPAC Name |
n-[2-methyl-5-[[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)benzoyl]amino]phenyl]isoxazole-5-carboxamide |
Molecular Mass |
469.416 g·mol−1 |
Heat of Formation |
-572.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.38 ± 1.08 D |
Volume |
506.4 Å 3 |
Surface Area |
461.37 Å 2 |
HOMO Energy |
-8.93 ± 0.55 eV |
LUMO Energy |
-1.43 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
IYUFHBXMTTXZBE-UHFFFAOYSA-N |
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Elements |
H
C
F
O
N
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