Geometry & MOs

Info

ID:	168080
PubChem CID:	74921417
Reduced:	NO5C28H35 (1)
Stoich.:	AB5C28D35 (1)
Weight, g/mol:	409.188923
ΔH_f, kcal/mol:	-150.54
Dipole, Da:	3.29
IP(EA), eV:	-8.22(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(2,5-dimethoxyphenyl)-6-methoxy-7-methyl-1-benzofuran-5-yl]-N-ethylbut-2-enamide

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)C=C(C)C1=C(C(=C2C(=C1)C(=CO2)C3=CC(=C(C=C3)OC)OC)C)OC

DOS

IR

Vibrations