Geometry & MOs

Info

ID:	7668
PubChem CID:	73685
Reduced:	O7H12C20 (1)
Stoich.:	A7B12C20 (1)
Weight, g/mol:	364.058303
ΔH_f, kcal/mol:	-193.05
Dipole, Da:	6.06
IP(EA), eV:	-8.98(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3',4',5',6'-tetrahydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)O)OC5=C3C=CC(=C5O)O

DOS

IR

Vibrations