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

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Properties Simple | Detailed

Formula C16H13ClN2O3S
IUPAC Name 4-chloro-6-[5-(4-ethoxyphenyl)thiadiazol-4-yl]benzene-1,3-diol
Molecular Mass 348.804 g·mol−1
Heat of Formation -200.8 ± 16.7 kJ·mol−1
Dipole Moment 6.29 ± 1.08 D
Volume 376.6 Å 3
Surface Area 329.28 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
InChIKey RFRZSMIYYCXYNL-UHFFFAOYSA-N
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