Geometry & MOs

Info

ID:	403024
PubChem CID:	135058360
Reduced:	NOC15H25 (1)
Stoich.:	ABC15D25 (1)
Weight, g/mol:	319.120843
ΔH_f, kcal/mol:	-71.93
Dipole, Da:	3.73
IP(EA), eV:	-9.29(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-(1H-indol-3-yl)-1-benzofuran-2-yl]acetate

Drug info:

PubChemData

Smile

CC(C)(C)OC=NC12CC3CC(C1)CC(C3)C2

DOS

IR

Vibrations