Geometry & MOs

Info

ID:	256108
PubChem CID:	103137111
Reduced:	N3H15C16 (1)
Stoich.:	A3B15C16 (1)
Weight, g/mol:	267.117176
ΔH_f, kcal/mol:	66.55
Dipole, Da:	3.85
IP(EA), eV:	-8.17(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-N-(2-fluoro-4-methylphenyl)isoquinoline-5,8-diamine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations