(1Z)-1-(3-Ethyl-5-Hydroxy-1,3-Benzothiazol-2(3H)-Ylidene)Acetone

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Properties Simple | Detailed

Formula C12H13NO2S
IUPAC Name (1z)-1-(3-ethyl-5-hydroxy-1,3-benzothiazol-2-ylidene)propan-2-one
Molecular Mass 235.302 g·mol−1
Heat of Formation -232.8 ± 16.7 kJ·mol−1
Dipole Moment 6.07 ± 1.08 D
Volume 272.99 Å 3
Surface Area 253.26 Å 2
HOMO Energy -8.13 ± 0.55 eV
LUMO Energy 2.44 ± eV
Point Group Symmetry C1
InChIKey GCSZJMUFYOAHFY-SDQBBNPISA-N
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