Geometry & MOs

Info

ID:	338457
PubChem CID:	127259149
Reduced:	NI2O3H11C13 (1)
Stoich.:	AB2C3D11E13 (1)
Weight, g/mol:	292.094688
ΔH_f, kcal/mol:	-46.18
Dipole, Da:	4.0
IP(EA), eV:	-8.86(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-acetyl-4-methoxy-1-benzofuran-6-yl)oxy]ethyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCCOC1=C(C=C(C2=C1N=CC=C2)I)I

DOS

IR

Vibrations