Geometry & MOs

Info

ID:	7979
PubChem CID:	74560
Reduced:	O4C11H14 (1)
Stoich.:	A4B11C14 (1)
Weight, g/mol:	210.089209
ΔH_f, kcal/mol:	-134.1
Dipole, Da:	5.99
IP(EA), eV:	-8.34(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4,5-trimethoxyphenyl)ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=C(C=C1OC)OC)OC

DOS

IR

Vibrations