1-(2,4-Difluoro-1,3,5-Triazin-1(2H)-Yl)-2-Methyl-2H-Isoindole

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Properties Simple | Detailed

Formula C12H10F2N4
IUPAC Name 1-[(2s)-2,4-difluoro-2h-1,3,5-triazin-1-yl]-2-methyl-isoindole
Molecular Mass 248.231 g·mol−1
Heat of Formation 17.1 ± 16.7 kJ·mol−1
Dipole Moment 6.59 ± 1.08 D
Volume 274.84 Å 3
Surface Area 249.17 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 2.10 ± eV
Point Group Symmetry C1
InChIKey MFYLOZZDOMQETI-GFCCVEGCSA-N
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Elements H C N F