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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Links |
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Elements |
H
C
N
O
Cl
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