Geometry & MOs

Info

ID:	12937
PubChem CID:	218910
Reduced:	OSCl2N2C17H22 (1)
Stoich.:	ABC2D2E17F22 (1)
Weight, g/mol:	372.08299
ΔH_f, kcal/mol:	-45.54
Dipole, Da:	2.9
IP(EA), eV:	-9.1(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(4-chloroquinolin-2-yl)oxypentyl]-1,3-thiazolidine;hydrochloride

Drug info:

PubChemData

Smile

C1CSCN1CCCCCOC2=NC3=CC=CC=C3C(=C2)Cl.Cl

DOS

IR

Vibrations