Formula |
C22H30BrN3O4 |
IUPAC Name |
n-[4-bromo-2-[(3s,5r)-3,5-dimethylpiperidine-1-carbonyl]phenyl]-4-morpholino-4-oxo-butanamide |
Molecular Mass |
480.395 g·mol−1 |
Heat of Formation |
-730.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.17 ± 1.08 D |
Volume |
529.71 Å 3 |
Surface Area |
445.43 Å 2 |
HOMO Energy |
-9.01 ± 0.55 eV |
LUMO Energy |
2.31 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
DELARNBPJXTDBD-IYBDPMFKSA-N |
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Links |
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Elements |
H
C
Br
O
N
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