Formula |
C27H31I2NO5 |
IUPAC Name |
[(1s)-1-methylpropyl] 2-[3-[4-[2-(diethylamino)ethoxy]-3,5-diiodo-benzoyl]benzofuran-2-yl]acetate |
Molecular Mass |
703.348 g·mol−1 |
Heat of Formation |
-527.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.13 ± 1.08 D |
Volume |
651.4 Å 3 |
Surface Area |
530.77 Å 2 |
HOMO Energy |
-8.80 ± 0.55 eV |
LUMO Energy |
-0.89 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- [(2s)-butan-2-yl] 2-[3-[4-(2-diethylaminoethoxy)-3,5-diiodo-phenyl]carbonyl-1-benzofuran-2-yl]ethanoate
- [(2s)-butan-2-yl] 2-[3-[4-(2-diethylaminoethoxy)-3,5-diiodobenzoyl]-1-benzofuran-2-yl]acetate
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InChIKey |
ZXOSVKYCXLTVGS-KRWDZBQOSA-N |
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