2-[(1S)-1,2,2,2-Tetrafluoroethyl]-1H-Benzimidazole

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Properties Simple | Detailed

Formula C9H6F4N2
IUPAC Name 2-[(1s)-1,2,2,2-tetrafluoroethyl]benzimidazol-1-ium-2-ylium
Molecular Mass 218.151 g·mol−1
Heat of Formation -622.8 ± 16.7 kJ·mol−1
Dipole Moment 4.93 ± 1.08 D
Volume 218.48 Å 3
Surface Area 211.82 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
InChIKey QOXFGGCVUDFHNX-ZETCQYMHSA-N
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Elements H C N F