Thiobutacin

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Properties Simple | Detailed

Formula C11H13NO3S
IUPAC Name (2s)-4-(2-aminophenyl)-2-methylsulfanyl-4-oxo-butanoic acid
Molecular Mass 239.291 g·mol−1
Heat of Formation -481.3 ± 16.7 kJ·mol−1
Dipole Moment 2.03 ± 1.08 D
Volume 275.18 Å 3
Surface Area 257.13 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey DGBICJRAEAUCGO-JTQLQIEISA-N
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