(3Z)-3-[(3S)-3-Hydroxy-3-Methyl-1,3-Dihydro-2H-Indol-2-Ylidene]-5-[(4-Hydroxy-1-Piperidinyl)Sulfonyl]-1,3-Dihydro-2H-Indol-2-One

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Properties Simple | Detailed

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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