Geometry & MOs

Info

ID:	201247
PubChem CID:	79511612
Reduced:	OSN2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	248.036797
ΔH_f, kcal/mol:	8.89
Dipole, Da:	1.49
IP(EA), eV:	-8.79(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6-methoxy-1,3-benzothiazol-2-yl)-1,2,5-oxadiazol-3-amine

Drug info:

PubChemData

Smile

CNCC1=NC2=C(S1)C=C(C=C2)OC

DOS

IR

Vibrations