Formula |
C20H23ClFN3O3S2 |
IUPAC Name |
(e)-2-(5-chloro-2-thienyl)-n-[(3s)-1-[4-[(1r)-1-(dimethylamino)ethyl]-2-fluoro-phenyl]-2-oxo-pyrrolidin-3-yl]ethenesulfonamide |
Molecular Mass |
471.996 g·mol−1 |
Heat of Formation |
-438.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.15 ± 1.08 D |
Volume |
522.71 Å 3 |
Surface Area |
438.87 Å 2 |
HOMO Energy |
-8.90 ± 0.55 eV |
LUMO Energy |
1.75 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
AFDHTIFDRFSZDA-IUJLQVPDSA-N |
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Links |
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Elements |
C
F
H
Cl
O
N
S
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