Geometry & MOs

Info

ID:	160983
PubChem CID:	57390437
Reduced:	SO2N3H19C20 (1)
Stoich.:	AB2C3D19E20 (1)
Weight, g/mol:	376.997011
ΔH_f, kcal/mol:	18.55
Dipole, Da:	5.93
IP(EA), eV:	-8.88(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-dichloro-N-[(E)-(4-nitrophenyl)methylideneamino]-1-benzofuran-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)OC)C4=NC(=O)CS4

DOS

IR

Vibrations