(2E)-3-{(2R)-3-[(2S,4R)-4-Hydroxy-2-Hexanyl]-2-Methyl-2-Oxiranyl}-N-[(2S,3S)-1-Hydroxy-3-Methyl-2-Pentanyl]Acrylamide

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Properties Simple | Detailed

Formula C18H33NO4
IUPAC Name (e)-n-[(1s,2s)-1-(hydroxymethyl)-2-methyl-butyl]-3-[(2r,3s)-3-[(1s,3r)-3-hydroxy-1-methyl-pentyl]-2-methyl-oxiran-2-yl]prop-2-enamide
Molecular Mass 327.459 g·mol−1
Heat of Formation -827.7 ± 16.7 kJ·mol−1
Dipole Moment 2.17 ± 1.08 D
Volume 448.26 Å 3
Surface Area 360.97 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
InChIKey KQYIQWJQJFWGMP-WXDFVLQISA-N
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