(2S)-1-[(2S,3S)-3-Carboxylato-3-{[(3S)-3-Carboxylato-3-Hydroxypropyl]Ammonio}-2-Hydroxypropyl]-2-Azetidinecarboxylate

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Formula C12H20N2O8
IUPAC Name (1s,2s)-1-[(2s,3r)-3-carboxy-3-[[(3r)-3-carboxy-3-hydroxy-propyl]amino]-2-hydroxy-propyl]azetidine-2-carboxylic acid
Molecular Mass 320.296 g·mol−1
Heat of Formation -1446.3 ± 16.7 kJ·mol−1
Dipole Moment 2.06 ± 1.08 D
Volume 367.67 Å 3
Surface Area 333.02 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 0.40 ± eV
Point Group Symmetry C1
InChIKey GJRGEVKCJPPZIT-UYXSQOIJSA-N
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