N-{2-[(1R,3R)-3-{[(2R)-3-(2-Allylphenoxy)-2-Hydroxypropyl]Amino}-3-Methylcyclohexyl]-2-Propanyl}-2-Bromoacetamide

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Formula C24H37BrN2O3
IUPAC Name n-[1-[(1s,3r)-3-[[(2s)-3-(2-allylphenoxy)-2-hydroxy-propyl]amino]-3-methyl-cyclohexyl]-1-methyl-ethyl]-2-bromo-acetamide
Molecular Mass 481.466 g·mol−1
Heat of Formation -586.3 ± 16.7 kJ·mol−1
Dipole Moment 3.24 ± 1.08 D
Volume 572.37 Å 3
Surface Area 404.92 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
InChIKey RTYBGDQNUBLFSW-MZLICYQSSA-N
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Elements H C O Br N