Geometry & MOs

Info

ID:	2946
PubChem CID:	8910
Reduced:	NSO6C16H37 (1)
Stoich.:	ABC6D16E37 (1)
Weight, g/mol:	371.234159
ΔH_f, kcal/mol:	-319.51
Dipole, Da:	2.0
IP(EA), eV:	-9.6(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dodecyl hydrogen sulfate;2-(2-hydroxyethylamino)ethanol

Drug info:

PubChemData

Smile

CCCCCCCCCCCCOS(=O)(=O)O.C(CO)NCCO

DOS

IR

Vibrations