Geometry & MOs

Info

ID:	270668
PubChem CID:	103637553
Reduced:	SN2O2H12C15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	366.91817
ΔH_f, kcal/mol:	-18.44
Dipole, Da:	5.61
IP(EA), eV:	-8.77(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-6-yl)-5-bromo-2-chloropyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC(=O)NC2=CC3=C(C=C2)N=CS3)O

DOS

IR

Vibrations