Formula |
C33H38N2O6 |
IUPAC Name |
tert-butyl n-[3-[3-[(s)-[6-[(1r)-1-benzylpropyl]-4-hydroxy-2-oxo-pyran-3-yl]-cycloprop-2-en-1-yl-methyl]anilino]-3-oxo-propyl]carbamate |
Molecular Mass |
558.665 g·mol−1 |
Heat of Formation |
-720.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.74 ± 1.08 D |
Volume |
693.7 Å 3 |
Surface Area |
593.85 Å 2 |
HOMO Energy |
-8.64 ± 0.55 eV |
LUMO Energy |
2.49 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OORLDLMDGJZAFM-MNNSJKJDSA-N |
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Elements |
H
C
O
N
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