Geometry & MOs

Info

ID:	19357
PubChem CID:	562499
Reduced:	NC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	214.146999
ΔH_f, kcal/mol:	40.45
Dipole, Da:	3.37
IP(EA), eV:	-8.96(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-benzylpiperidin-4-yl)acetonitrile

Drug info:

PubChemData

Smile

C1CN(CCC1CC#N)CC2=CC=CC=C2

DOS

IR

Vibrations