Geometry & MOs

Info

ID:	429388
PubChem CID:	135169411
Reduced:	OF2N2C11H18 (1)
Stoich.:	AB2C2D11E18 (1)
Weight, g/mol:	214.021227
ΔH_f, kcal/mol:	-124.36
Dipole, Da:	3.16
IP(EA), eV:	-8.55(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=C(F)F)N2CCOCC2

DOS

IR

Vibrations