Geometry & MOs

Info

ID:	10056
PubChem CID:	96589
Reduced:	NOSH7C8 (1)
Stoich.:	ABCD7E8 (1)
Weight, g/mol:	165.024835
ΔH_f, kcal/mol:	12.67
Dipole, Da:	3.06
IP(EA), eV:	-9.17(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-1,3-benzothiazole

Drug info:

PubChemData

Smile

COC1=NC2=CC=CC=C2S1

DOS

IR

Vibrations