(2S)-2-({[(1S)-1-Carboxy-2-(2-Oxiranyl)Ethyl]Carbamoyl}Amino)-6-[(4-Iodobenzoyl)Amino]Hexanoic Acid

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Formula C19H24IN3O7
IUPAC Name (2s)-2-[[(1s)-1-carboxy-2-[(2s)-oxiran-2-yl]ethyl]carbamoylamino]-6-[(4-iodobenzoyl)amino]hexanoic acid
Molecular Mass 533.314 g·mol−1
Heat of Formation -1063.8 ± 16.7 kJ·mol−1
Dipole Moment 3.25 ± 1.08 D
Volume 531.46 Å 3
Surface Area 470.52 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 2.22 ± eV
Point Group Symmetry C1
InChIKey JIMADGCYCYENTN-KKUMJFAQSA-N
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