Geometry & MOs

Info

ID:	8939
PubChem CID:	83811
Reduced:	NC5H8 (2)
Stoich.:	AB5C8 (2)
Weight, g/mol:	164.131349
ΔH_f, kcal/mol:	19.73
Dipole, Da:	1.76
IP(EA), eV:	-9.08(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-benzylpropane-1,3-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNCCCN

DOS

IR

Vibrations