3-(Methylsulfanyl)-L-Aspartic Acid

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Properties Simple | Detailed

Formula C5H9NO4S
IUPAC Name 2-amino-3-methylsulfanyl-butanedioic acid
Molecular Mass 179.194 g·mol−1
Heat of Formation -748.6 ± 16.7 kJ·mol−1
Dipole Moment 1.81 ± 1.08 D
Volume 198.31 Å 3
Surface Area 189.94 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
InChIKey AOSGDBLMPHPJQU-HRFVKAFMSA-N
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