(2S)-2-Amino-3-(4-Hydroxy-3-Oxo-Cyclohexa-1,4-Dien-1-Yl)Propanoic Acid

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Properties Simple | Detailed

Formula C9H11NO4
IUPAC Name (2s)-2-amino-3-(4-hydroxy-3-oxo-cyclohexa-1,4-dien-1-yl)propanoic acid
Molecular Mass 197.188 g·mol−1
Heat of Formation -615.3 ± 16.7 kJ·mol−1
Dipole Moment 4.88 ± 1.08 D
Volume 228.8 Å 3
Surface Area 218.14 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 2.23 ± eV
Point Group Symmetry C1
InChIKey WVLZCYURJPAARZ-LURJTMIESA-N
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