Formula |
C31H42F2N2O5 |
IUPAC Name |
(2r)-5-[[(1s,2r)-3-[[1-(3-tert-butylphenyl)cyclohexyl]amino]-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-propyl]amino]-2-hydroxy-5-oxo-pentanoic acid |
Molecular Mass |
560.672 g·mol−1 |
Heat of Formation |
-1416.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.86 ± 1.08 D |
Volume |
692.02 Å 3 |
Surface Area |
513.96 Å 2 |
HOMO Energy |
-8.99 ± 0.55 eV |
LUMO Energy |
-0.31 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZQBAKJWCBZPMKW-OYUWMTPXSA-N |
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Elements |
H
C
F
O
N
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