4-({(2S)-2-[2-(4-Chlorophenyl)-5,6-Difluoro-1H-Benzimidazol-1-Yl]-2-Cyclohexylacetyl}Amino)Benzoic Acid

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Formula C28H24ClF2N3O3
IUPAC Name 4-[[(2s)-2-[2-(4-chlorophenyl)-5,6-difluoro-benzimidazol-1-ium-2-ylium-1-yl]-2-cyclohexyl-acetyl]amino]benzoic acid
Molecular Mass 523.958 g·mol−1
Heat of Formation -630.9 ± 16.7 kJ·mol−1
Dipole Moment 5.33 ± 1.08 D
Volume 585.81 Å 3
Surface Area 461.45 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy 1.71 ± eV
Point Group Symmetry C1
InChIKey OZGKPOZAIWDSQB-VWLOTQADSA-N
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