Geometry & MOs

Info

ID:	160560
PubChem CID:	57389043
Reduced:	OSN3C18H25 (1)
Stoich.:	ABC3D18E25 (1)
Weight, g/mol:	411.174726
ΔH_f, kcal/mol:	10.31
Dipole, Da:	1.16
IP(EA), eV:	-8.55(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[6-(4-methoxyphenoxy)hexyl]piperazin-1-yl]-1,3-thiazole;hydrochloride

Drug info:

PubChemData

Smile

C1CN(CCN1CCCCCOC2=CC=CC=C2)C3=NC=CS3

DOS

IR

Vibrations