Formula |
C32H38INO4 |
IUPAC Name |
6-[4-[(e)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenoxy]-n-[2-(4-hydroxy-3-(125i)iodanyl-phenyl)ethyl]hexanamide |
Molecular Mass |
625.553 g·mol−1 |
Heat of Formation |
-566.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.36 ± 1.08 D |
Volume |
688.85 Å 3 |
Surface Area |
508.98 Å 2 |
HOMO Energy |
-8.58 ± 0.55 eV |
LUMO Energy |
2.66 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MJKWBAVJMPZEJN-ZQHSETAFSA-N |
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