3-(~131~I)Iodotyrosyl-N-{1-Chloro-6-[(Diaminomethylene)Amino]-2-Oxo-3-Hexanyl}Prolinamide

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Properties Simple | Detailed

Formula C21H30ClIN6O4
IUPAC Name 1-[2-amino-3-(4-hydroxy-3-iodo-phenyl)propanoyl]-n-[1-(2-chloroacetyl)-4-guanidino-butyl]pyrrolidine-2-carboxamide
Molecular Mass 592.858 g·mol−1
Heat of Formation -634.2 ± 16.7 kJ·mol−1
Dipole Moment 11.69 ± 1.08 D
Volume 592.43 Å 3
Surface Area 442.13 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 2.79 ± eV
Point Group Symmetry C1
InChIKey DRUDCIXYRLXCIP-XHSDSOJGSA-N
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