Geometry & MOs

Info

ID:	256067
PubChem CID:	103136830
Reduced:	N3C17H17 (1)
Stoich.:	A3B17C17 (1)
Weight, g/mol:	249.126598
ΔH_f, kcal/mol:	69.06
Dipole, Da:	2.49
IP(EA), eV:	-7.78(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-N-benzylisoquinoline-5,8-diamine

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations