Geometry & MOs

Info

ID:	160505
PubChem CID:	57309853
Reduced:	NS2O3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	350.249081
ΔH_f, kcal/mol:	-45.52
Dipole, Da:	6.7
IP(EA), eV:	-8.49(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hexyldecoxy)ethanesulfonic acid

Drug info:

PubChemData

Smile

CS(=O)C1=CC=C(C=C1)C(C2=C(C=C(C=C2)S(=O)C)O)N

DOS

IR

Vibrations