Formula |
C29H24F3N5O |
IUPAC Name |
n-[3-[3-[4-[(dimethylamino)methyl]phenyl]pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]-3-(trifluoromethyl)benzamide |
Molecular Mass |
515.529 g·mol−1 |
Heat of Formation |
-185.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.08 ± 1.08 D |
Volume |
589.83 Å 3 |
Surface Area |
515.99 Å 2 |
HOMO Energy |
-8.30 ± 0.55 eV |
LUMO Energy |
1.81 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
AIWJVLQNYNCDSL-UHFFFAOYSA-N |
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Elements |
H
C
N
O
F
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