Formula |
C25H40ClN5O4 |
IUPAC Name |
4-amino-5-chloro-n-[(1r,3r,4r)-1-[4-[4-(dimethylamino)-1-piperidyl]-4-oxo-butyl]-3-methoxy-4-piperidyl]-2-methoxy-benzamide |
Molecular Mass |
510.069 g·mol−1 |
Heat of Formation |
-756.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.70 ± 1.08 D |
Volume |
623.52 Å 3 |
Surface Area |
435.23 Å 2 |
HOMO Energy |
-8.75 ± 0.55 eV |
LUMO Energy |
-0.20 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YEXQFGBCXUNVRL-FYYLOGMGSA-N |
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Links |
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Downloads |
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Elements |
H
C
N
O
Cl
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