(2S)-2-(3-Amino-2,4,6-Triiodobenzyl)Butanoic Acid

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Properties Simple | Detailed

Formula C11H12I3NO2
IUPAC Name (2s)-2-[(3-amino-2,4,6-triiodo-phenyl)methyl]butanoic acid
Molecular Mass 570.932 g·mol−1
Heat of Formation -141.6 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 362.9 Å 3
Surface Area 299.33 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
InChIKey OIRFJRBSRORBCM-YFKPBYRVSA-N
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