Formula |
C16H18F3N3O3S |
IUPAC Name |
(2s,4r)-n-(1-methanimidoylcyclopropyl)-4-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide |
Molecular Mass |
389.393 g·mol−1 |
Heat of Formation |
-828.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.13 ± 1.08 D |
Volume |
417.31 Å 3 |
Surface Area |
358.28 Å 2 |
HOMO Energy |
-9.73 ± 0.55 eV |
LUMO Energy |
-1.22 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
WIKZXNNJWQPKLI-FGAGOUGJSA-N |
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Links |
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Elements |
C
F
H
O
N
S
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