Geometry & MOs

Info

ID:	23868
PubChem CID:	606893
Reduced:	O6C19H20 (1)
Stoich.:	A6B19C20 (1)
Weight, g/mol:	344.125988
ΔH_f, kcal/mol:	-178.14
Dipole, Da:	3.42
IP(EA), eV:	-8.55(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propane-1,2-dione

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC(=O)C(=O)C2=C(C=C(C=C2OC)OC)OC

DOS

IR

Vibrations