Geometry & MOs

Info

ID:	168064
PubChem CID:	74919049
Reduced:	N2O3C21H28 (1)
Stoich.:	A2B3C21D28 (1)
Weight, g/mol:	476.140593
ΔH_f, kcal/mol:	-89.34
Dipole, Da:	3.73
IP(EA), eV:	-8.49(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-methoxy-7-methyl-3-phenyl-1-benzofuran-5-yl)-N-(4-sulfamoylphenyl)but-2-enamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C(=O)C=C(C)C2=C(C(=C3C(=C2)C(=CO3)C)C)OC

DOS

IR

Vibrations