Geometry & MOs

Info

ID:	304518
PubChem CID:	124756137
Reduced:	ON5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	51.12
Dipole, Da:	7.31
IP(EA), eV:	-8.6(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]methyl]-1,2,5-oxadiazole

Drug info:

PubChemData

Smile

CC1=C2C[C@H](OC2=NC(=N1)C)CN(C)CC3=CC(=NN3)C4=CC=CC=C4

DOS

IR

Vibrations