4-[5-(4-Ethoxyphenyl)-1,2,3-Thiadiazol-4-Yl]-6-Ethyl-1,3-Benzenediol

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Properties Simple | Detailed

Formula C18H18N2O3S
IUPAC Name 4-[5-(4-ethoxyphenyl)thiadiazol-4-yl]-6-ethyl-benzene-1,3-diol
Molecular Mass 342.412 g·mol−1
Heat of Formation -228.7 ± 16.7 kJ·mol−1
Dipole Moment 7.56 ± 1.08 D
Volume 400.25 Å 3
Surface Area 335.39 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
InChIKey DUXCVYIPXRRATG-UHFFFAOYSA-N
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