5-Fluoro-2-(4-Methyl-1-Piperazinyl)Benzoic Acid

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Formula C12H15FN2O2
IUPAC Name 5-fluoro-2-(4-methylpiperazin-4-ium-1-yl)benzoate
Molecular Mass 238.258 g·mol−1
Heat of Formation -418.5 ± 16.7 kJ·mol−1
Dipole Moment 2.83 ± 1.08 D
Volume 282.53 Å 3
Surface Area 252.73 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 2.35 ± eV
Point Group Symmetry C1
InChIKey KBFDOPUFARGNDL-UHFFFAOYSA-N
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