Formula |
C26H36N2O4 |
IUPAC Name |
(2s)-2-(3,4-dimethoxyphenyl)-5-[2-[3,4-di(methoxy)phenyl]ethylamino]-2-isopropyl-pentanenitrile |
Molecular Mass |
440.575 g·mol−1 |
Heat of Formation |
-442.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.10 ± 1.08 D |
Volume |
568.4 Å 3 |
Surface Area |
497.38 Å 2 |
HOMO Energy |
-8.31 ± 0.55 eV |
LUMO Energy |
-0.25 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UPKQNCPKPOLASS-SANMLTNESA-N |
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Elements |
H
C
O
N
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