Geometry & MOs

Info

ID:	14338
PubChem CID:	409762
Reduced:	ClON3H16C17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	313.09819
ΔH_f, kcal/mol:	17.3
Dipole, Da:	5.11
IP(EA), eV:	-8.73(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[4-[(7-chloroquinolin-4-yl)amino]phenyl]ethanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(CN)O)NC2=C3C=CC(=CC3=NC=C2)Cl

DOS

IR

Vibrations