Geometry & MOs

Info

ID:	4374
PubChem CID:	11308
Reduced:	O5C10H12 (1)
Stoich.:	A5B10C12 (1)
Weight, g/mol:	212.068473
ΔH_f, kcal/mol:	-174.95
Dipole, Da:	8.0
IP(EA), eV:	-9.3(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,4-trimethoxybenzoic acid

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C(=O)O)OC)OC

DOS

IR

Vibrations