Geometry & MOs

Info

ID:	374121
PubChem CID:	131323972
Reduced:	ON2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	202.110613
ΔH_f, kcal/mol:	-6.41
Dipole, Da:	4.1
IP(EA), eV:	-9.11(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-hydroxypiperidin-4-yl)benzonitrile

Drug info:

PubChemData

Smile

C1CCC2=C(C=CC(=C2C1)C(C#N)N)O

DOS

IR

Vibrations