Geometry & MOs

Info

ID:	269280
PubChem CID:	103616691
Reduced:	ClSN2O2H9C14 (1)
Stoich.:	ABC2D2E9F14 (1)
Weight, g/mol:	393.96368
ΔH_f, kcal/mol:	-17.18
Dipole, Da:	5.95
IP(EA), eV:	-8.85(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-6-yl)-2-iodo-3-methylbenzamide

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1NC(=O)C3=C(C=CC(=C3)Cl)O)SC=N2

DOS

IR

Vibrations