Formula |
C28H26ClN3O3 |
IUPAC Name |
2-(3h-pyridin-1-ium-3-id-6-yl)ethyl (4r)-4-(2-chlorophenyl)-2,6-dimethyl-5-(phenylcarbamoyl)-1,4-dihydropyridine-3-carboxylate |
Molecular Mass |
487.977 g·mol−1 |
Heat of Formation |
-287.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.12 ± 1.08 D |
Volume |
570.31 Å 3 |
Surface Area |
420.78 Å 2 |
HOMO Energy |
-8.62 ± 0.55 eV |
LUMO Energy |
2.71 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YGKDFWHVQNDMLG-SANMLTNESA-N |
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Links |
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Elements |
H
C
N
O
Cl
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