S-(2-Carboxy-2-Hydroxyethyl)Homocysteine

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Properties Simple | Detailed

Formula C7H13NO5S
IUPAC Name (2s)-2-amino-4-[(2r)-2-carboxy-2-hydroxy-ethyl]sulfanyl-butanoic acid
Molecular Mass 223.247 g·mol−1
Heat of Formation -981.0 ± 16.7 kJ·mol−1
Dipole Moment 0.94 ± 1.08 D
Volume 249.27 Å 3
Surface Area 221.13 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
InChIKey ALEACLRVRWTCEO-WHFBIAKZSA-N
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