Geometry & MOs

Info

ID:	28506
PubChem CID:	828002
Reduced:	FON2H15C19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	238.084124
ΔH_f, kcal/mol:	-17.44
Dipole, Da:	4.3
IP(EA), eV:	-8.75(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-acetyl-4,5-dimethoxyphenyl)acetic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)F

DOS

IR

Vibrations