Formula |
C31H35Cl2F6N3O3 |
IUPAC Name |
2-[1-[2-[(2s)-4-[2-[3,5-bis(trifluoromethyl)phenyl]acetyl]-2-(3,4-dichlorophenyl)morpholin-2-yl]ethyl]-4-piperidyl]-2-methyl-propanamide |
Molecular Mass |
682.524 g·mol−1 |
Heat of Formation |
-1889.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.75 ± 1.08 D |
Volume |
752.98 Å 3 |
Surface Area |
530.23 Å 2 |
HOMO Energy |
-9.02 ± 0.55 eV |
LUMO Energy |
1.46 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZLNYUCXXSDDIFU-GDLZYMKVSA-N |
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Links |
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Elements |
C
F
H
Cl
O
N
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