(5Z)-3-Propyl-5-[(E,4Z)-4-[(1S)-1-(4-Sulfobutyl)-2,3,5,6,7,8-Hexahydroquinoline-2,3,4A,5,6,7,8,8A-Octaid-4-Ylidene]But-2-Enylidene]-2-Thioxo-Thiazolidin-4-One

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Formula C23H37N2O4S3+
IUPAC Name (5z)-3-propyl-5-[(e,4z)-4-[(1s)-1-(4-sulfobutyl)-2,3,5,6,7,8-hexahydroquinoline-2,3,4a,5,6,7,8,8a-octaid-4-ylidene]but-2-enylidene]-2-thioxo-thiazolidin-4-one
Molecular Mass 501.746 g·mol−1
Heat of Formation -374.6 ± 16.7 kJ·mol−1
Dipole Moment 6.97 ± 1.08 D
Volume 569.03 Å 3
Surface Area 500.9 Å 2
HOMO Energy -8.07 ± 0.55 eV
LUMO Energy -1.85 ± eV
Point Group Symmetry C1
InChIKey BZAZXWMZCUDYAI-MRLUILNMSA-O
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