Geometry & MOs

Info

ID:	346695
PubChem CID:	127271199
Reduced:	FO2N4C21H27 (1)
Stoich.:	AB2C4D21E27 (1)
Weight, g/mol:	386.211804
ΔH_f, kcal/mol:	-73.27
Dipole, Da:	1.41
IP(EA), eV:	-9.48(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-1-(4-methylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)CN2CCCC(C2)C3=NC(=NO3)C4=CC(=CC=C4)F

DOS

IR

Vibrations