2-[4-(Dimethylamino)Phenyl]-6-Hydroxy-3-Methyl-1,3-Benzothiazol-3-Ium

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Properties Simple | Detailed

Formula C16H17N2OS+
IUPAC Name 2-[4-(dimethylamino)phenyl]-3-methyl-1,3-benzothiazol-3-ium-6-ol
Molecular Mass 285.384 g·mol−1
Heat of Formation 2588.2 ± 16.7 kJ·mol−1
Dipole Moment 3.80 ± 1.08 D
Volume 305.58 Å 3
Surface Area 287.94 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -3.19 ± eV
Point Group Symmetry C1
InChIKey NOVJJPLRUMZSDK-UHFFFAOYSA-O
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