1-(2,6-Difluorophenyl)-6-Methyl-1H,3H-Thiazolo(3,4-A)Benzimidazole

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Properties Simple | Detailed

Formula C16H12F2N2S
IUPAC Name (1r)-1-(2,6-difluorophenyl)-6-methyl-1,3-dihydrothiazolo[3,4-a]benzimidazole
Molecular Mass 302.342 g·mol−1
Heat of Formation -60.0 ± 16.7 kJ·mol−1
Dipole Moment 4.01 ± 1.08 D
Volume 329.43 Å 3
Surface Area 287.39 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
InChIKey MVEYGWOKRBJXKP-MRXNPFEDSA-N
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Elements H S N C F