2-({1-[(1-Oxo-1,3-Dihydro-2H-Isoindol-2-Yl)Methyl]-3,4-Dihydro-2(1H)-Isoquinolinyl}Carbonyl)Cyclohexanecarboxylic Acid

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Formula C26H28N2O4
IUPAC Name (1s,2r)-2-[(1s)-1-[(1-oxoisoindolin-2-yl)methyl]-3,4-dihydro-1h-isoquinoline-2-carbonyl]cyclohexanecarboxylic acid
Molecular Mass 432.512 g·mol−1
Heat of Formation -583.2 ± 16.7 kJ·mol−1
Dipole Moment 6.32 ± 1.08 D
Volume 511.41 Å 3
Surface Area 377.86 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
InChIKey CENUFSLZJTXDBJ-XPWALMASSA-N
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