N-{6-[3-(1-Piperazinyl)Phenyl]-2-Pyridinyl}-4-(Trifluoromethyl)-2-Pyridinamine

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Properties Simple | Detailed

Formula C21H20F3N5
IUPAC Name 6-(3-piperazin-1-ylphenyl)-n-[4-(trifluoromethyl)-2-pyridyl]pyridin-2-amine
Molecular Mass 399.412 g·mol−1
Heat of Formation -224.8 ± 16.7 kJ·mol−1
Dipole Moment 4.07 ± 1.08 D
Volume 460.56 Å 3
Surface Area 389.03 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
InChIKey FCPDILGNMHIWJE-UHFFFAOYSA-N
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Elements H C F N