Geometry & MOs

Info

ID:	167722
PubChem CID:	74863290
Reduced:	NOC7H9 (3)
Stoich.:	ABC7D9 (3)
Weight, g/mol:	412.120526
ΔH_f, kcal/mol:	-65.34
Dipole, Da:	7.98
IP(EA), eV:	-8.43(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[1-[4-(furan-2-ylmethylsulfamoyl)phenyl]ethylideneamino]benzamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)C(=NNC(=O)C2=CC=C(C=C2)N)C)OCCC

DOS

IR

Vibrations