Geometry & MOs

Info

ID:	5737
PubChem CID:	13625
Reduced:	NOSH5C7 (1)
Stoich.:	ABCD5E7 (1)
Weight, g/mol:	151.009185
ΔH_f, kcal/mol:	-15.44
Dipole, Da:	4.11
IP(EA), eV:	-9.11(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3H-1,3-benzothiazol-2-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=O)S2

DOS

IR

Vibrations