Geometry & MOs

Info

ID:	4810
PubChem CID:	12073
Reduced:	O2C9H10 (1)
Stoich.:	A2B9C10 (1)
Weight, g/mol:	150.06808
ΔH_f, kcal/mol:	-77.83
Dipole, Da:	6.61
IP(EA), eV:	-9.77(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethylbenzoic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)O)C

DOS

IR

Vibrations