Geometry & MOs

Info

ID:	29722
PubChem CID:	836712
Reduced:	BrOS2N3H8C10 (1)
Stoich.:	ABC2D3E8F10 (1)
Weight, g/mol:	348.060235
ΔH_f, kcal/mol:	42.38
Dipole, Da:	3.75
IP(EA), eV:	-8.5(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations