N-Hexanoyl-L-Valyl-N~1~-[(3S,4S)-3-Hydroxy-2,6-Dimethyl-1-Hepten-4-Yl]-N~5~,N~5~-Dimethyl-L-Glutamamide

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Properties Simple | Detailed

Formula C27H50N4O5
IUPAC Name (2s)-2-[[(2s)-2-(hexanoylamino)-3-methyl-butanoyl]amino]-n-[(1s,2s)-2-hydroxy-1-isobutyl-3-methyl-but-3-enyl]-n',n'-dimethyl-pentanediamide
Molecular Mass 510.710 g·mol−1
Heat of Formation -1297.4 ± 16.7 kJ·mol−1
Dipole Moment 5.97 ± 1.08 D
Volume 693.59 Å 3
Surface Area 559.31 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 0.68 ± eV
Point Group Symmetry C1
InChIKey KBKIHHNRHOTMRE-NBMBROAQSA-N
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