Formula |
C25H21F3N4O3S |
IUPAC Name |
n-[[4-(4-phenylthiazol-2-yl)tetrahydropyran-4-yl]methyl]-3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzamide |
Molecular Mass |
514.519 g·mol−1 |
Heat of Formation |
-541.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.38 ± 1.08 D |
Volume |
559.18 Å 3 |
Surface Area |
455.15 Å 2 |
HOMO Energy |
-9.32 ± 0.55 eV |
LUMO Energy |
1.56 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
HORXBWNTEDOVKN-UHFFFAOYSA-N |
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Elements |
C
F
H
O
N
S
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