Geometry & MOs

Info

ID:	280776
PubChem CID:	103851218
Reduced:	N4C17H26 (1)
Stoich.:	A4B17C26 (1)
Weight, g/mol:	271.204848
ΔH_f, kcal/mol:	43.91
Dipole, Da:	2.73
IP(EA), eV:	-8.25(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(3-methyl-2-pyrrolidin-1-ylbutyl)amino]methyl]benzonitrile

Drug info:

PubChemData

Smile

CC(C)(CNCC1=CC=CC=C1C#N)N2CCN(CC2)C

DOS

IR

Vibrations