Geometry & MOs

Info

ID:	374319
PubChem CID:	131326701
Reduced:	ON4C10H14 (1)
Stoich.:	AB4C10D14 (1)
Weight, g/mol:	206.116761
ΔH_f, kcal/mol:	22.25
Dipole, Da:	4.02
IP(EA), eV:	-8.71(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(piperidin-2-ylmethyl)-1,2,4-oxadiazol-5-yl]acetonitrile

Drug info:

PubChemData

Smile

CC1=C(N=C(N1)C2=C(ON=C2C)C)CN

DOS

IR

Vibrations