Geometry & MOs

Info

ID:	162196
PubChem CID:	57393914
Reduced:	FSN3O5H30C32 (1)
Stoich.:	ABC3D5E30F32 (1)
Weight, g/mol:	280.084792
ΔH_f, kcal/mol:	-113.52
Dipole, Da:	8.34
IP(EA), eV:	-8.6(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-1-benzofuran-3-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(CC(=O)CCC3=CC4=C(C=C3)C=C(C=C4)OC)C5=CC(=CC=C5)F

DOS

IR

Vibrations