Geometry & MOs

Info

ID:	280133
PubChem CID:	103847108
Reduced:	ON4C11H18 (1)
Stoich.:	AB4C11D18 (1)
Weight, g/mol:	231.137162
ΔH_f, kcal/mol:	-18.75
Dipole, Da:	2.29
IP(EA), eV:	-8.93(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(methoxymethyl)piperidin-1-yl]pyridine-4-carbonitrile

Drug info:

PubChemData

Smile

COCC1CCCN(C1)C2=NC=NC(=C2)N

DOS

IR

Vibrations