Formula |
C24H26FN3O6S2 |
IUPAC Name |
n-[[3-[(2s)-2-tert-butyl-1-[(4-fluorophenyl)methyl]-3-hydroxy-5-oxo-2h-pyrrol-4-yl]-1,1-dioxo-1,2-benzothiazol-7-yl]methyl]methanesulfonamide |
Molecular Mass |
535.608 g·mol−1 |
Heat of Formation |
-898.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.78 ± 1.08 D |
Volume |
590.25 Å 3 |
Surface Area |
470.19 Å 2 |
HOMO Energy |
-9.70 ± 0.55 eV |
LUMO Energy |
-1.34 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZMOVBEOGACXUBZ-JOCHJYFZSA-N |
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Links |
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Elements |
C
F
H
O
N
S
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