Formula |
C24H31N3O3 |
IUPAC Name |
isopropyl n-[(2s,4r)-1-acetyl-2-methyl-6-[4-(methylaminomethyl)phenyl]-3,4-dihydro-2h-quinolin-4-yl]carbamate |
Molecular Mass |
409.521 g·mol−1 |
Heat of Formation |
-471.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.88 ± 1.08 D |
Volume |
519.65 Å 3 |
Surface Area |
434.14 Å 2 |
HOMO Energy |
-8.84 ± 0.55 eV |
LUMO Energy |
-0.59 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
PXCIUCWFKRTXSJ-KSFYIVLOSA-N |
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Elements |
H
C
O
N
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