Geometry & MOs

Info

ID:	443650
PubChem CID:	135259667
Reduced:	SO3H14C20 (1)
Stoich.:	AB3C14D20 (1)
Weight, g/mol:	318.089209
ΔH_f, kcal/mol:	-31.46
Dipole, Da:	6.92
IP(EA), eV:	-8.96(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(4-methoxyphenyl)furan-2-yl]chromen-2-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CC=C(S2)C3=CC(=O)OC4=CC=CC=C43

DOS

IR

Vibrations