Geometry & MOs

Info

ID:	433370
PubChem CID:	135173507
Reduced:	NSO3C11H25 (1)
Stoich.:	ABC3D11E25 (1)
Weight, g/mol:	219.165686
ΔH_f, kcal/mol:	-156.97
Dipole, Da:	5.45
IP(EA), eV:	-9.09(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethoxypropylsulfanyl)ethyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CCOCCCS(=O)(=O)CCNCC(C)C

DOS

IR

Vibrations