Geometry & MOs

Info

ID:	247373
PubChem CID:	103070578
Reduced:	N3C9H17 (1)
Stoich.:	A3B9C17 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	31.78
Dipole, Da:	5.96
IP(EA), eV:	-9.27(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(cyclopropylamino)methyl]prop-2-enyl-(2-methoxyethyl)amino]propanenitrile

Drug info:

PubChemData

Smile

CC(CC#N)N(C)CC(=C)CN

DOS

IR

Vibrations