Formula |
C20H19ClF5NO4 |
IUPAC Name |
o5-isopropyl o3-methyl (4r)-4-[3-chloro-6-fluoro-2-(trifluoromethyl)phenyl]-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Mass |
467.814 g·mol−1 |
Heat of Formation |
-1682.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.05 ± 1.08 D |
Volume |
479.58 Å 3 |
Surface Area |
382.17 Å 2 |
HOMO Energy |
-8.90 ± 0.55 eV |
LUMO Energy |
-0.68 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OBWJAVIHPMZUHG-INIZCTEOSA-N |
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Links |
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Elements |
C
F
H
Cl
O
N
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