Geometry & MOs

Info

ID:	268458
PubChem CID:	103599468
Reduced:	O3N6H20C24 (1)
Stoich.:	A3B6C20D24 (1)
Weight, g/mol:	407.128134
ΔH_f, kcal/mol:	73.45
Dipole, Da:	7.86
IP(EA), eV:	-9.09(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-acetamido-4-fluoroanilino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CC1N2C(=NN=N2)C3=CC(=CC=C3)NC(=O)C(=CC4=CC=CO4)NC(=O)C5=CC=CC=C5

DOS

IR

Vibrations