Geometry & MOs

Info

ID:	3834
PubChem CID:	10276
Reduced:	O5C10H12 (1)
Stoich.:	A5B10C12 (1)
Weight, g/mol:	212.068473
ΔH_f, kcal/mol:	-178.61
Dipole, Da:	6.48
IP(EA), eV:	-8.82(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,5-trimethoxybenzoic acid

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(=O)O)OC)OC

DOS

IR

Vibrations