Geometry & MOs

Info

ID:	9389
PubChem CID:	88944
Reduced:	O3C10H12 (1)
Stoich.:	A3B10C12 (1)
Weight, g/mol:	180.078644
ΔH_f, kcal/mol:	-113.4
Dipole, Da:	6.29
IP(EA), eV:	-9.3(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-3,5-dimethylbenzoic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OC)C)C(=O)O

DOS

IR

Vibrations