Geometry & MOs

Info

ID:	397025
PubChem CID:	135029618
Reduced:	O7C20H22 (1)
Stoich.:	A7B20C22 (1)
Weight, g/mol:	388.115818
ΔH_f, kcal/mol:	-196.6
Dipole, Da:	4.44
IP(EA), eV:	-8.39(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethoxyphenyl)-3-hydroxy-6,7,8-trimethoxychromen-4-one

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)/C=C/C(=O)C2=CC(=C(C(=C2O)OC)OC)OC

DOS

IR

Vibrations