(3S)-3-({[1-(2-Fluorophenyl)-5-Oxo-2,5-Dihydro-1H-Pyrazol-3-Yl]Carbonyl}Amino)-3-(2-Methylphenyl)Propanoic Acid

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Formula C20H18FN3O4
IUPAC Name (3s)-3-[[1-(2-fluorophenyl)-5-oxo-pyrazole-1,2-diium-3-carbonyl]amino]-3-(o-tolyl)propanoic acid
Molecular Mass 383.373 g·mol−1
Heat of Formation -537.9 ± 16.7 kJ·mol−1
Dipole Moment 4.44 ± 1.08 D
Volume 436.73 Å 3
Surface Area 383.89 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 1.93 ± eV
Point Group Symmetry C1
InChIKey DGGLFHJMXJUSDG-HNNXBMFYSA-N
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