Geometry & MOs

Info

ID:	2768
PubChem CID:	8485
Reduced:	SO3C18H30 (1)
Stoich.:	AB3C18D30 (1)
Weight, g/mol:	326.191566
ΔH_f, kcal/mol:	-163.33
Dipole, Da:	5.95
IP(EA), eV:	-10.34(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-dodecylbenzenesulfonic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O

DOS

IR

Vibrations