Geometry & MOs

Info

ID:	383671
PubChem CID:	134975526
Reduced:	ClOSN2C6H7 (1)
Stoich.:	ABCD2E6F7 (1)
Weight, g/mol:	353.94544
ΔH_f, kcal/mol:	-22.45
Dipole, Da:	2.35
IP(EA), eV:	-9.05(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-iodo-N,N,1-trimethyl-2,1-benzothiazol-3-amine

Drug info:

PubChemData

Smile

CC(=O)N1C(=CSC1=N)CCl

DOS

IR

Vibrations