Geometry & MOs

Info

ID:	2699
PubChem CID:	8335
Reduced:	O5H14C17 (1)
Stoich.:	A5B14C17 (1)
Weight, g/mol:	298.084124
ΔH_f, kcal/mol:	-137.24
Dipole, Da:	3.74
IP(EA), eV:	-9.08(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(furan-2-yl)-3-oxobutyl]-2-hydroxychromen-4-one

Drug info:

PubChemData

Smile

CC(=O)CC(C1=CC=CO1)C2=C(OC3=CC=CC=C3C2=O)O

DOS

IR

Vibrations