Geometry & MOs

Info

ID:	174524
PubChem CID:	75778094
Reduced:	O2N4C21H28 (1)
Stoich.:	A2B4C21D28 (1)
Weight, g/mol:	386.211804
ΔH_f, kcal/mol:	-36.07
Dipole, Da:	6.55
IP(EA), eV:	-8.27(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1CCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)OC

DOS

IR

Vibrations