2-[4-(Methylamino)Phenyl]-1,3-Benzothiazol-6-Ol

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Properties Simple | Detailed

Formula C14H12N2OS
IUPAC Name 2-[4-(methylamino)phenyl]-1,3-benzothiazol-3-ium-7a-id-6-ol
Molecular Mass 256.323 g·mol−1
Heat of Formation 113.2 ± 16.7 kJ·mol−1
Dipole Moment 3.63 ± 1.08 D
Volume 294.51 Å 3
Surface Area 277.5 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy 2.26 ± eV
Point Group Symmetry C1
Synonyms
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  • 6
  • a
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InChIKey ZQAQXZBSGZUUNL-UHFFFAOYSA-N
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