Geometry & MOs

Info

ID:	429423
PubChem CID:	135169472
Reduced:	FN3H12C17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	210.046299
ΔH_f, kcal/mol:	47.13
Dipole, Da:	3.33
IP(EA), eV:	-8.75(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-methoxy-7-methyl-1,3-benzothiazol-6-ol

Drug info:

PubChemData

Smile

CC1=CC2=C(NC=C2C3=CC(=C4C(=C3)C=CC=N4)F)N=C1

DOS

IR

Vibrations