(2R)-2-({N-[(2R)-2-Ammonio-3-Chloropropanoyl]-3-Chloro-L-Alanyl}Amino)-3-Chloropropanoate

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Formula C9H14Cl3N3O4
IUPAC Name (2s)-2-[[(2r)-2-[[(2s)-2-amino-3-chloro-propanoyl]amino]-3-chloro-propanoyl]amino]-3-chloro-propanoic acid
Molecular Mass 334.584 g·mol−1
Heat of Formation -905.6 ± 16.7 kJ·mol−1
Dipole Moment 4.12 ± 1.08 D
Volume 349.73 Å 3
Surface Area 301.92 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
InChIKey OCPJWTOBPNWJLW-NGJCXOISSA-N
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Elements H C N O Cl