Formula |
C19H26IN3O6S |
IUPAC Name |
2-[(1-carboxy-3-methylsulfanyl-propyl)carbamoylamino]-6-[(4-iodobenzoyl)amino]hexanoic acid |
Molecular Mass |
551.396 g·mol−1 |
Heat of Formation |
-1037.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.83 ± 1.08 D |
Volume |
563.24 Å 3 |
Surface Area |
498.25 Å 2 |
HOMO Energy |
-8.67 ± 0.55 eV |
LUMO Energy |
2.33 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
AWPLYTCEHNMVNJ-GJZGRUSLSA-N |
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Elements |
C
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