Geometry & MOs

Info

ID:	2883
PubChem CID:	8777
Reduced:	NSO7C18H41 (1)
Stoich.:	ABC7D18E41 (1)
Weight, g/mol:	415.260374
ΔH_f, kcal/mol:	-367.76
Dipole, Da:	3.91
IP(EA), eV:	-9.25(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[bis(2-hydroxyethyl)amino]ethanol;dodecyl hydrogen sulfate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO

DOS

IR

Vibrations