(3S,4E)-3-Hydroxy-7-Mercapto-4-Heptenoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C7H12O3S
IUPAC Name (e,3s)-3-hydroxy-7-sulfanyl-hept-4-enoic acid
Molecular Mass 176.233 g·mol−1
Heat of Formation -572.2 ± 16.7 kJ·mol−1
Dipole Moment 3.33 ± 1.08 D
Volume 217.6 Å 3
Surface Area 217.67 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 2.53 ± eV
Point Group Symmetry C1
InChIKey UNSBLAMOMWTOIP-OFRQFNDLSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O