2-(1,1-Difluoroethyl)-5-Methyl-N-[4-(Trifluoromethyl)Phenyl][1,2,4]Triazolo[1,5-A]Pyrimidin-7-Amine

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Formula C15H12F5N5
IUPAC Name 2-(1,1-difluoroethyl)-5-methyl-n-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Molecular Mass 357.281 g·mol−1
Heat of Formation 1926.9 ± 16.7 kJ·mol−1
Dipole Moment 2.16 ± 1.08 D
Volume 355.84 Å 3
Surface Area 311.6 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -2.93 ± eV
Point Group Symmetry C1
InChIKey CUCVTDOXQYMYKL-UHFFFAOYSA-N
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Elements C N F