Geometry & MOs

Info

ID:	18434
PubChem CID:	540921
Reduced:	O5H12C19 (1)
Stoich.:	A5B12C19 (1)
Weight, g/mol:	320.068473
ΔH_f, kcal/mol:	-97.46
Dipole, Da:	2.08
IP(EA), eV:	-9.25(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(1-benzofuran-2-carbonyl)-1-benzofuran-5-yl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC2=C(C=C1)OC=C2C(=O)C3=CC4=CC=CC=C4O3

DOS

IR

Vibrations