Geometry & MOs

Info

ID:	268464
PubChem CID:	103599510
Reduced:	F2N2O5H20C23 (1)
Stoich.:	A2B2C5D20E23 (1)
Weight, g/mol:	445.200156
ΔH_f, kcal/mol:	-210.57
Dipole, Da:	7.07
IP(EA), eV:	-8.81(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[2-benzamido-3-(furan-2-yl)prop-2-enoyl]amino]methyl]-N,N-diethylbenzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CNC(=O)C(=CC2=CC=CO2)NC(=O)C3=CC=CC=C3)OC(F)F

DOS

IR

Vibrations