Formula |
C27H38N2O8S |
IUPAC Name |
[(5r)-1,3-dioxepan-5-yl] n-[(1s,2r)-1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]carbamate |
Molecular Mass |
550.664 g·mol−1 |
Heat of Formation |
-1360.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.88 ± 1.08 D |
Volume |
661.13 Å 3 |
Surface Area |
464.81 Å 2 |
HOMO Energy |
-9.16 ± 0.55 eV |
LUMO Energy |
2.97 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LEJNWIFUYPPOMU-DMTNHVFBSA-N |
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Elements |
H
C
S
O
N
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