N-{[(2S,3S)-3-(Ethoxycarbonyl)-2-Oxiranyl]Carbonyl}-L-Isoleucyl-L-Isoleucine

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Formula C18H30N2O7
IUPAC Name (2s,3s)-2-[[(2s,3s)-2-[[(2s,3s)-3-ethoxycarbonyloxirane-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid
Molecular Mass 386.440 g·mol−1
Heat of Formation -1314.2 ± 16.7 kJ·mol−1
Dipole Moment 4.56 ± 1.08 D
Volume 486.11 Å 3
Surface Area 419.4 Å 2
HOMO Energy -9.96 ± 0.55 eV
LUMO Energy 3.40 ± eV
Point Group Symmetry C1
InChIKey CFABOFMUPCWOPC-LHEWDLALSA-N
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