Geometry & MOs

Info

ID:	17044
PubChem CID:	482807
Reduced:	O7H26C31 (1)
Stoich.:	A7B26C31 (1)
Weight, g/mol:	510.167853
ΔH_f, kcal/mol:	-162.34
Dipole, Da:	2.8
IP(EA), eV:	-8.41(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3,4-bis(phenylmethoxy)phenyl]-4-hydroxy-3,7-dimethoxychromen-5-one

Drug info:

PubChemData

Smile

COC1=CC(=O)C2=C(C(=C(OC2=C1)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC)O

DOS

IR

Vibrations