2-Fluoro-N-{[4-(6-Methyl-2-Pyridinyl)-5-([1,2,4]Triazolo[1,5-A]Pyridin-6-Yl)-1H-Imidazol-2-Yl]Methyl}Aniline

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Properties Simple | Detailed

Formula C22H18FN7
IUPAC Name 2-fluoro-n-[[5-(6-methyl-2-pyridyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1h-imidazol-2-yl]methyl]aniline
Molecular Mass 399.424 g·mol−1
Heat of Formation 496.2 ± 16.7 kJ·mol−1
Dipole Moment 7.67 ± 1.08 D
Volume 459.56 Å 3
Surface Area 406.88 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
InChIKey FJCDSQATIJKQKA-UHFFFAOYSA-N
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Elements H C N F