Geometry & MOs

Info

ID:	8009
PubChem CID:	74709
Reduced:	O5C9H10 (1)
Stoich.:	A5B9C10 (1)
Weight, g/mol:	198.052823
ΔH_f, kcal/mol:	-175.46
Dipole, Da:	6.19
IP(EA), eV:	-8.96(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-4,5-dimethoxybenzoic acid

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)O)C(=O)O

DOS

IR

Vibrations