Formula |
C31H36N4O5 |
IUPAC Name |
(2s)-n-[(2s)-2-[benzyl(methyl)amino]-3-[(1r)-4,4-dihydroxy-1-(1h-indole-3-carbonyl)cyclohex-2-en-1-yl]propanoyl]pyrrolidine-2-carboxamide |
Molecular Mass |
544.641 g·mol−1 |
Heat of Formation |
-631.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.55 ± 1.08 D |
Volume |
648.23 Å 3 |
Surface Area |
481.89 Å 2 |
HOMO Energy |
-8.75 ± 0.55 eV |
LUMO Energy |
-0.38 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
IFWOFNMURCNNHO-BRWNIOCJSA-N |
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Elements |
H
C
O
N
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