(E,3S)-3-Hydroxy-7-Methylsulfanyl-Hept-4-Enoic Acid

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Formula C8H14O3S
IUPAC Name (e,3s)-3-hydroxy-7-methylsulfanyl-hept-4-enoic acid
Molecular Mass 190.260 g·mol−1
Heat of Formation -581.5 ± 16.7 kJ·mol−1
Dipole Moment 3.66 ± 1.08 D
Volume 239.04 Å 3
Surface Area 237.33 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy 3.03 ± eV
Point Group Symmetry C1
InChIKey XJDXZZBSTXLALG-NUOXCJHRSA-N
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Elements H C S O