Formula |
C22H23N3O5S |
IUPAC Name |
(3z)-3-[(3s)-3-hydroxy-3-methyl-indolin-2-ylidene]-5-[(4-hydroxy-1-piperidyl)sulfonyl]indolin-2-one |
Molecular Mass |
441.500 g·mol−1 |
Heat of Formation |
-647.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.40 ± 1.08 D |
Volume |
492.84 Å 3 |
Surface Area |
404.25 Å 2 |
HOMO Energy |
-8.57 ± 0.55 eV |
LUMO Energy |
-1.44 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
AYOAIABDFUJDKQ-SQJPUDIVSA-N |
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Elements |
H
C
S
O
N
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