Formula |
C18H14F3N5O3S |
IUPAC Name |
5-[6-(ethylcarbamoylamino)-4-[4-(trifluoromethyl)thiazol-2-yl]-3-pyridyl]pyridine-3-carboxylic acid |
Molecular Mass |
437.396 g·mol−1 |
Heat of Formation |
-785.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.95 ± 1.08 D |
Volume |
461.52 Å 3 |
Surface Area |
406.07 Å 2 |
HOMO Energy |
-9.46 ± 0.55 eV |
LUMO Energy |
1.37 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
GLNFAHNABSNEAM-UHFFFAOYSA-N |
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Links |
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Elements |
C
F
H
O
N
S
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