Geometry & MOs

Info

ID:	256132
PubChem CID:	103137261
Reduced:	NC4H4 (4)
Stoich.:	AB4C4 (4)
Weight, g/mol:	253.121512
ΔH_f, kcal/mol:	88.59
Dipole, Da:	4.01
IP(EA), eV:	-9.14(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-N-[1-(furan-2-yl)ethyl]isoquinoline-5,8-diamine

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(C2=CC=CC3=C2C=NC=C3)NC

DOS

IR

Vibrations