Formula |
C21H15F3N4O3 |
IUPAC Name |
1-[(2-amino-4-pyridyl)methyl]-3-(2-oxo-1h-pyridin-3-yl)-5-(trifluoromethyl)indole-2-carboxylic acid |
Molecular Mass |
428.364 g·mol−1 |
Heat of Formation |
-817.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.51 ± 1.08 D |
Volume |
453.64 Å 3 |
Surface Area |
384.15 Å 2 |
HOMO Energy |
-8.67 ± 0.55 eV |
LUMO Energy |
1.88 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
CNFSTRPHYZHTGV-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
F
O
N
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