N~2~-Acetyl-N-(4-Chloro-3-Oxo-1-Phenyl-2-Pentanyl)Alaninamide

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Properties Simple | Detailed

Formula C16H21ClN2O3
IUPAC Name (2s)-2-acetamido-n-[(1s,3s)-1-benzyl-3-chloro-2-oxo-butyl]propanamide
Molecular Mass 324.803 g·mol−1
Heat of Formation -587.9 ± 16.7 kJ·mol−1
Dipole Moment 3.42 ± 1.08 D
Volume 402.08 Å 3
Surface Area 336.19 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
InChIKey YNWKVSAREQNJGP-MJVIPROJSA-N
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Elements H C N O Cl