Formula |
C17H18F3N3O4 |
IUPAC Name |
2-aminoethyl (4r)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate |
Molecular Mass |
385.338 g·mol−1 |
Heat of Formation |
-930.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.84 ± 1.08 D |
Volume |
407.43 Å 3 |
Surface Area |
324.12 Å 2 |
HOMO Energy |
-9.19 ± 0.55 eV |
LUMO Energy |
1.94 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
RCJFYGYHESLEHK-AWEZNQCLSA-N |
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Elements |
H
C
N
O
F
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