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

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Properties Simple | Detailed

Formula C21H15F3N2O2
IUPAC Name 4-[1-benzyl-7-(trifluoromethyl)indazol-3-yl]benzene-1,3-diol
Molecular Mass 384.351 g·mol−1
Heat of Formation -583.6 ± 16.7 kJ·mol−1
Dipole Moment 2.97 ± 1.08 D
Volume 417.94 Å 3
Surface Area 344.98 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -1.44 ± eV
Point Group Symmetry C1
InChIKey LXPUCQLYLWGFLV-UHFFFAOYSA-N
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