Geometry & MOs

Info

ID:	4838
PubChem CID:	12126
Reduced:	O3C9H10 (1)
Stoich.:	A3B9C10 (1)
Weight, g/mol:	166.062994
ΔH_f, kcal/mol:	-105.81
Dipole, Da:	7.0
IP(EA), eV:	-9.39(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxybenzoic acid

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C(=O)O

DOS

IR

Vibrations