Geometry & MOs

Info

ID:	1965
PubChem CID:	5443
Reduced:	SO2H6C7 (1)
Stoich.:	AB2C6D7 (1)
Weight, g/mol:	154.008851
ΔH_f, kcal/mol:	-58.18
Dipole, Da:	6.17
IP(EA), eV:	-9.37(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-sulfanylbenzoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)O)S

DOS

IR

Vibrations