N-{3-Acetyl-4-[2-Hydroxy-3-(Isopropylamino)Propoxy]Phenyl}-2-(~125~I)Iodobenzamide

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Properties Simple | Detailed

Formula C21H25IN2O4
IUPAC Name n-[3-acetyl-4-[(2r)-2-hydroxy-3-(isopropylamino)propoxy]phenyl]-2-iodo-benzamide
Molecular Mass 496.339 g·mol−1
Heat of Formation -486.0 ± 16.7 kJ·mol−1
Dipole Moment 5.02 ± 1.08 D
Volume 502.89 Å 3
Surface Area 436.61 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
InChIKey KXNPTVLZWGRHRX-KSHWYKAGSA-N
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