N-(Trans-4-{(2S,3S)-3-Amino-4-[(3S)-3-Fluoro-1-Pyrrolidinyl]-4-Oxo-2-Butanyl}Cyclohexyl)-N-Methylacetamide

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Properties Simple | Detailed

Formula C17H30FN3O2
IUPAC Name n-[4-[(1s,2s)-2-amino-3-[(3s)-3-fluoropyrrolidin-1-yl]-1-methyl-3-oxo-propyl]cyclohexyl]-n-methyl-acetamide
Molecular Mass 327.437 g·mol−1
Heat of Formation -715.6 ± 16.7 kJ·mol−1
Dipole Moment 5.00 ± 1.08 D
Volume 419.87 Å 3
Surface Area 351.51 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 4.04 ± eV
Point Group Symmetry C1
InChIKey BZFQBRSDORUYAB-YDMUCJKGSA-N
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