5-Oxo-L-Prolyl-N-{[(2S)-1-Ethyl-2-Pyrrolidinyl]Carbonyl}-3-(4H-Imidazol-4-Yl)-L-Alaninamide

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Properties Simple | Detailed

Formula C18H26N6O4
IUPAC Name (2s)-n-[(1s)-2-[[(1r,2s)-1-ethylpyrrolidine-2-carbonyl]amino]-1-[[(4s)-4h-imidazol-4-yl]methyl]-2-oxo-ethyl]-5-oxo-pyrrolidine-2-carboxamide
Molecular Mass 390.437 g·mol−1
Heat of Formation -492.7 ± 16.7 kJ·mol−1
Dipole Moment 6.24 ± 1.08 D
Volume 478.22 Å 3
Surface Area 416.39 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
InChIKey WNJHRQYIEOTVOM-XUXIUFHCSA-N
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