Formula |
C33H34N4O6 |
IUPAC Name |
o3-(1-benzhydrylazetidin-3-yl) o5-isopropyl (4s)-2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Mass |
582.646 g·mol−1 |
Heat of Formation |
-357.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
12.09 ± 1.08 D |
Volume |
701.76 Å 3 |
Surface Area |
513.36 Å 2 |
HOMO Energy |
-8.94 ± 0.55 eV |
LUMO Energy |
2.22 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZKFQEACEUNWPMT-NDEPHWFRSA-N |
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Links |
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Elements |
H
C
O
N
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