Geometry & MOs

Info

ID:	256507
PubChem CID:	103139639
Reduced:	FNO2H14C17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	270.055991
ΔH_f, kcal/mol:	-55.4
Dipole, Da:	3.59
IP(EA), eV:	-9.22(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(2-chlorophenoxy)isoquinolin-5-amine

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(C2=CC=CC3=C2C=NC=C3)O)F

DOS

IR

Vibrations