Geometry & MOs

Info

ID:	247371
PubChem CID:	103070535
Reduced:	N3C12H25 (1)
Stoich.:	A3B12C25 (1)
Weight, g/mol:	195.173548
ΔH_f, kcal/mol:	1.4
Dipole, Da:	2.48
IP(EA), eV:	-8.59(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(ethylaminomethyl)prop-2-enyl-methylamino]butanenitrile

Drug info:

PubChemData

Smile

CCN(CC)C1CCN(C1)CC(=C)CN

DOS

IR

Vibrations