Geometry & MOs

Info

ID:	168092
PubChem CID:	74923619
Reduced:	NF2O4H27C29 (1)
Stoich.:	AB2C4D27E29 (1)
Weight, g/mol:	393.194008
ΔH_f, kcal/mol:	-175.39
Dipole, Da:	7.38
IP(EA), eV:	-8.41(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-ethoxy-3-(3-methoxyphenyl)-7-methyl-1-benzofuran-5-yl]-N,N-dimethylbut-2-enamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C2C(=COC2=C1C)C3=CC(=CC=C3)OC)C(=CC(=O)NCC4=C(C=CC=C4F)F)C

DOS

IR

Vibrations