Geometry & MOs

Info

ID:	158306
PubChem CID:	56463328
Reduced:	N3O4C24H25 (1)
Stoich.:	A3B4C24D25 (1)
Weight, g/mol:	448.120526
ΔH_f, kcal/mol:	-96.87
Dipole, Da:	5.55
IP(EA), eV:	-8.55(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]benzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C(=O)NC2=C(C=CC(=C2)C)NC(=O)C)OCC3=CN=CC=C3

DOS

IR

Vibrations