Geometry & MOs

Info

ID:	200891
PubChem CID:	79459603
Reduced:	FNSC16H18 (1)
Stoich.:	ABCD16E18 (1)
Weight, g/mol:	262.093998
ΔH_f, kcal/mol:	1.06
Dipole, Da:	2.3
IP(EA), eV:	-9.07(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-(3-fluorophenyl)azetidin-3-yl]methyl]-2-methyl-1,3-thiazole

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CC2(CNC2)C3=CC(=CC=C3)F

DOS

IR

Vibrations