2-(3,4-Dimethoxy-Phenyl)-4-Fluoro-B; Enzothiazole

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Properties Simple | Detailed

Formula C15H12FNO2S
IUPAC Name 2-(3,4-dimethoxyphenyl)-4-fluoro-1,3-benzothiazole
Molecular Mass 289.325 g·mol−1
Heat of Formation -183.3 ± 16.7 kJ·mol−1
Dipole Moment 2.92 ± 1.08 D
Volume 320.18 Å 3
Surface Area 295.39 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
Synonyms
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InChIKey NQTJLOVYFPWUND-UHFFFAOYSA-N
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