Geometry & MOs

Info

ID:	131253
PubChem CID:	51182140
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	329.162708
ΔH_f, kcal/mol:	-81.28
Dipole, Da:	3.72
IP(EA), eV:	-9.23(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2,4-dimethoxyphenyl)-N-[4-(furan-2-yl)butan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(CCC1=CC=CO1)NC(=O)/C=C/C2=CC(=CC=C2)F

DOS

IR

Vibrations