Formula |
C23H26N2O8S2 |
IUPAC Name |
2-(3,4-dimethoxyphenoxy)ethyl (2s)-1-[(2-oxo-3h-1,3-benzothiazol-6-yl)sulfonyl]piperidine-2-carboxylate |
Molecular Mass |
522.591 g·mol−1 |
Heat of Formation |
-1113.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.60 ± 1.08 D |
Volume |
568.46 Å 3 |
Surface Area |
493.69 Å 2 |
HOMO Energy |
-8.18 ± 0.55 eV |
LUMO Energy |
1.87 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LKFOEMMDLYEDRW-SFHVURJKSA-N |
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Elements |
H
C
S
O
N
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