Geometry & MOs

Info

ID:	23168
PubChem CID:	602620
Reduced:	O5C17H18 (1)
Stoich.:	A5B17C18 (1)
Weight, g/mol:	302.115424
ΔH_f, kcal/mol:	-152.68
Dipole, Da:	4.13
IP(EA), eV:	-8.83(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxy-3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations