Geometry & MOs

Info

ID:	268477
PubChem CID:	103599536
Reduced:	O3N5H23C25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	419.184506
ΔH_f, kcal/mol:	13.87
Dipole, Da:	2.96
IP(EA), eV:	-8.92(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[4-[2-(dimethylamino)ethoxy]anilino]-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=NC=C(C=C2)CNC(=O)C(=CC3=CC=CO3)NC(=O)C4=CC=CC=C4)C

DOS

IR

Vibrations