Geometry & MOs

Info

ID:	281336
PubChem CID:	103913725
Reduced:	ON3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	281.119798
ΔH_f, kcal/mol:	-1.17
Dipole, Da:	2.23
IP(EA), eV:	-9.37(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-(3-cyanophenyl)ethylamino]propyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)CNC(C)C1=CC=CC(=C1)C#N

DOS

IR

Vibrations