Geometry & MOs

Info

ID:	10338
PubChem CID:	100625
Reduced:	O9C20H20 (1)
Stoich.:	A9B20C20 (1)
Weight, g/mol:	404.110732
ΔH_f, kcal/mol:	-275.81
Dipole, Da:	0.45
IP(EA), eV:	-8.64(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6,7,8-tetramethoxychromen-4-one

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C(=C(C(=C3O2)OC)OC)OC)O)OC)O

DOS

IR

Vibrations