3-{(5Z)-5-[5-Chloro-1-(2,6-Dichlorobenzyl)-2-Oxo-1,2-Dihydro-3H-Indol-3-Ylidene]-4-Oxo-2-Thioxo-1,3-Thiazolidin-3-Yl}Propanoic Acid

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Properties Simple | Detailed

Formula C21H13Cl3N2O4S2
IUPAC Name 3-[(5z)-5-[5-chloro-1-[(2,6-dichlorophenyl)methyl]-2-oxo-indolin-3-ylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid
Molecular Mass 527.828 g·mol−1
Heat of Formation -423.2 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 530.53 Å 3
Surface Area 437.86 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -2.55 ± eV
Point Group Symmetry C1
InChIKey YESAJFJEXWEXAO-ZCXUNETKSA-N
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