4-[2-Ethyl-7-(Trifluoromethyl)-2H-Indazol-3-Yl]-1,3-Benzenediol

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Properties Simple | Detailed

Formula C16H13F3N2O2
IUPAC Name 4-[2-ethyl-7-(trifluoromethyl)indazol-2-ium-3-yl]benzene-1,3-diol
Molecular Mass 322.282 g·mol−1
Heat of Formation -718.1 ± 16.7 kJ·mol−1
Dipole Moment 5.67 ± 1.08 D
Volume 348.65 Å 3
Surface Area 305.7 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.33 ± eV
Point Group Symmetry C1
InChIKey KBGLTSFNAOPVIO-UHFFFAOYSA-N
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