Geometry & MOs

Info

ID:	10347
PubChem CID:	100751
Reduced:	O6H12C19 (1)
Stoich.:	A6B12C19 (1)
Weight, g/mol:	336.063388
ΔH_f, kcal/mol:	-125.22
Dipole, Da:	1.91
IP(EA), eV:	-8.41(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(6-methoxy-1,3-benzodioxol-5-yl)furo[3,2-g]chromen-5-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1C3=COC4=C(C3=O)C=C5C=COC5=C4)OCO2

DOS

IR

Vibrations