N-[(3'-{[(1R)-1-(4-Chloro-3-Methylphenyl)Ethyl]Amino}-3,5-Dimethyl-4-Biphenylyl)Carbonyl]-L-Alanine

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Formula C27H29ClN2O3
IUPAC Name (2s)-2-[[4-[3-[[(1r)-1-(4-chloro-3-methyl-phenyl)ethyl]amino]phenyl]-2,6-dimethyl-benzoyl]amino]propanoic acid
Molecular Mass 464.984 g·mol−1
Heat of Formation -504.2 ± 16.7 kJ·mol−1
Dipole Moment 5.39 ± 1.08 D
Volume 570.04 Å 3
Surface Area 442.74 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy 2.72 ± eV
Point Group Symmetry C1
InChIKey KYHUARFFBDLROH-MOPGFXCFSA-N
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Elements H C N O Cl