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

Molecule SVG Image

Properties Simple | Detailed

Formula C14H11FN2OS
IUPAC Name 2-[3-fluoro-4-(methylamino)phenyl]-1,3-benzothiazol-3-ium-7a-id-6-ol
Molecular Mass 274.313 g·mol−1
Heat of Formation -70.8 ± 16.7 kJ·mol−1
Dipole Moment 2.52 ± 1.08 D
Volume 302.55 Å 3
Surface Area 284.14 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3-fluoro-4-methylamino-phenyl)-1,3-benzothiazol-6-ol
  • 2-(3-fluoro-4-methylaminophenyl)-1,3-benzothiazol-6-ol
InChIKey VVECGOCJFKTUAX-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N S