Geometry & MOs

Info

ID:	247372
PubChem CID:	103070577
Reduced:	N3C11H21 (1)
Stoich.:	A3B11C21 (1)
Weight, g/mol:	167.142248
ΔH_f, kcal/mol:	25.17
Dipole, Da:	3.14
IP(EA), eV:	-8.96(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations