3'-[(2S,4R)-6-Carbamimidoyl-4-Methyl-4-Phenyl-1,2,3,4-Tetrahydro-2-Quinolinyl]-4-Carbamoyl-2-Biphenylcarboxylic Acid

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Properties Simple | Detailed

Formula C31H28N4O3
IUPAC Name 2-[3-[(2s,4r)-6-carbamimidoyl-4-methyl-4-phenyl-2,3-dihydro-1h-quinolin-2-yl]phenyl]-5-carbamoyl-benzoic acid
Molecular Mass 504.579 g·mol−1
Heat of Formation -120.8 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 600.03 Å 3
Surface Area 501.47 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
InChIKey DPAVVGLNAXECAW-JTSJOTPCSA-N
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