Ethyl 2-(3-Amino-2,4,6-Triiodobenzyl)Butanoate

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Formula C13H16I3NO2
IUPAC Name ethyl (2r)-2-[(3-amino-2,4,6-triiodo-phenyl)methyl]butanoate
Molecular Mass 598.985 g·mol−1
Heat of Formation -163.1 ± 16.7 kJ·mol−1
Dipole Moment 1.95 ± 1.08 D
Volume 405.16 Å 3
Surface Area 319.07 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
InChIKey OBQUJIRCCAHNMD-SSDOTTSWSA-N
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