N-(2,6-Dichlorobenzoyl)-4-[1,6-Dimethyl-2-Oxo-4-(Trifluoromethyl)-1,2-Dihydro-3-Pyridinyl]-L-Phenylalanine

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Properties Simple | Detailed

Formula C24H19Cl2F3N2O4
IUPAC Name (2s)-2-[(2,6-dichlorobenzoyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridyl]phenyl]propanoic acid
Molecular Mass 527.320 g·mol−1
Heat of Formation -1264.7 ± 16.7 kJ·mol−1
Dipole Moment 7.73 ± 1.08 D
Volume 550.27 Å 3
Surface Area 436.13 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
InChIKey IBAZQIKVHCLTHH-SFHVURJKSA-O
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Elements C Cl H F O N