3-Iodotyrosyl-N-(6-Carbamimidamido-1-Chloro-2-Oxo-3-Hexanyl)Prolinamide

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Formula C21H30ClIN6O4
IUPAC Name (2r)-1-[(2s)-2-amino-3-(4-hydroxy-3-(131i)iodanyl-phenyl)propanoyl]-n-[(1s)-1-(2-chloroacetyl)-4-guanidino-butyl]pyrrolidine-2-carboxamide
Molecular Mass 596.860 g·mol−1
Heat of Formation -572.1 ± 16.7 kJ·mol−1
Dipole Moment 8.11 ± 1.08 D
Volume 613.28 Å 3
Surface Area 477.01 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy -0.19 ± eV
Point Group Symmetry C1
InChIKey DRUDCIXYRLXCIP-OWCLPIDISA-N
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