Geometry & MOs

Info

ID:	284865
PubChem CID:	104078896
Reduced:	OSN2C9H12 (1)
Stoich.:	ABC2D9E12 (1)
Weight, g/mol:	278.064447
ΔH_f, kcal/mol:	2.78
Dipole, Da:	4.22
IP(EA), eV:	-9.92(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(2-chlorophenyl)piperidin-4-yl]-1,3-thiazole

Drug info:

PubChemData

Smile

CCCC(C#N)C(C1=NC=CS1)O

DOS

IR

Vibrations