Formula |
C23H19FN4O3S |
IUPAC Name |
3-amino-6-fluoro-2-[4-(2-methyl-4-pyridyl)phenyl]-n-methylsulfonyl-quinoline-4-carboxamide |
Molecular Mass |
450.485 g·mol−1 |
Heat of Formation |
-343.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.83 ± 1.08 D |
Volume |
498.81 Å 3 |
Surface Area |
435.47 Å 2 |
HOMO Energy |
-9.04 ± 0.55 eV |
LUMO Energy |
-1.32 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OQQOHENQNGESNS-UHFFFAOYSA-N |
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Elements |
C
F
H
O
N
S
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