Geometry & MOs

Info

ID:	6041
PubChem CID:	14332
Reduced:	O4C9H10 (1)
Stoich.:	A4B9C10 (1)
Weight, g/mol:	182.057909
ΔH_f, kcal/mol:	-141.36
Dipole, Da:	5.65
IP(EA), eV:	-9.33(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxybenzoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations