Geometry & MOs

Info

ID:	136566
PubChem CID:	52065093
Reduced:	FON2C11H11 (2)
Stoich.:	ABC2D11E11 (2)
Weight, g/mol:	424.191069
ΔH_f, kcal/mol:	-76.03
Dipole, Da:	1.52
IP(EA), eV:	-9.3(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-methoxy-N-[1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCC(CC3)NC(=O)C4=CC(=CC(=C4)F)F

DOS

IR

Vibrations