(2S)-N-[(1S)-2-Amino-1-Benzyl-2-Oxo-Ethyl]-2-[(2-Iodoacetyl)Amino]-3-Methyl-Butanamide

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Formula C16H22IN3O3
IUPAC Name (2s)-n-[(1s)-2-amino-1-benzyl-2-oxo-ethyl]-2-[(2-iodoacetyl)amino]-3-methyl-butanamide
Molecular Mass 431.269 g·mol−1
Heat of Formation -522.1 ± 16.7 kJ·mol−1
Dipole Moment 1.70 ± 1.08 D
Volume 435.5 Å 3
Surface Area 357.61 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
InChIKey IBXSBHDYMGMZJA-JSGCOSHPSA-N
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