(4S)-N-[2-(4-Azido-3-Iodo-Phenyl)Ethyl]-4-[[(2S)-2-(3,4-Dihydroxyphenyl)-2-Hydroxy-Ethyl]Amino]Pentanamide

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Formula C21H27IN5O4
IUPAC Name (4s)-n-[2-(4-azido-3-iodo-phenyl)ethyl]-4-[[(2s)-2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]amino]pentanamide
Molecular Mass 540.375 g·mol−1
Heat of Formation -260.9 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 548.56 Å 3
Surface Area 398.68 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
InChIKey JSJVXBLWVWAGCH-RNODOKPDSA-N
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